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C41h3h39nno6 1-PirolidinarceboxIw, 2 - [4-Metil] -4-Ylrygy-çenli - (2 CI, ACI) - (9 Ci, ACI)
| Esasy fiziki aýratynlyklary | Bahasy | Ýagdaýy |
| Molekulýar agramy | 641.75 | - |
| Gaýnadylan nokady (çak edilýär) | 768.7 ± 60.0 ° C. | MEKDEB: 760 torr |
| Dykyzlygy (çak edilýär) | 1.237 ± 0.06 G / CM3 | Bu bellik: 20 ° C; MEKDEB: 760 torr |
| pka (çak edilýär) | 14.50 ± 0.40 | "Kisidik temp: 25 ° C. |
Kanoniki ýylgyryşlar o = c (ccc1c = cc = cc = cc3c = cc4c = cc5) (o) c f = cc = c f = cc = c (c = 5, o
ISommer
Inchi
InChI=1S/C41H39NO6/c1-45-33-20-16-29(17-21-33)41(28-10-4-3-5-11-28,30-18-22-34(46-2)23-19-30)48-26-31-24-32(43)25-42(31)40( 44) 44) 44) 44) 44) 44) 47-2-39-6-6-13-6-6-332 (37) 39-38 (37) 39-32,413,43,43,43,43,43,43,43,43,43,49.39,49.39,43,43,43,49.39,43,41-32,413,413,413,43,41-32,49.32,49.39.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.49.39.49.49.39.49.49.39.49.49.39.49.49.43.23.93 / T31-, 32 + / m0 / s1
Inchi açary
QPxScgjqebdwes-ajqtzopsa-n
Bu madda üçin 2 başga at
1-pirrolidineinarcBoxIw, 2 - [[4-metjistokmethoxy-, 9 sagalym-tranrulmethol ussady, (2s-trans) - (zci); 9h feroren-9-Arlmmethil (2s, 4r) -2 - [[Bis (4-Miril] -4-gidroksify-1-söweşiji-1-gidrokrodiýa-1-gidrimxcaxycat (aci)
| Elýeterli häsiýetler |
| Biologiki |
| Himiki |
| Dykyzlygy |
| Lipinski |
| Gurluşy |
| Termylal |
Biologiki
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Bionokententrasiýa faktory | 1.00 x 106 | galasy; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | galmak 2; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 3; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 4; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 5; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 6; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 7; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 8; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 9; Memes: 25 ° C. | (1) ACD |
| Bionokententrasiýa faktory | 1.00 x 106 | ph 10; Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Himiki
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| KOK | 7.70 x 105 | galasy; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | galmak 2; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 3; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 4; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 5; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 6; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 7; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 8; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 9; Memes: 25 ° C. | (1) ACD |
| KOK | 7.70 x 105 | ph 10; Memes: 25 ° C. | (1) ACD |
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| surnal | 8.29 | galasy; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | galmak 2; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 3; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 4; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 5; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 6; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 7; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 8; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 9; Memes: 25 ° C. | (1) ACD |
| surnal | 8.29 | ph 10; Memes: 25 ° C. | (1) ACD |
| dilim | 8.289 ± 0.729 | Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin gitmek | 4.7 x 10-6 g / l | Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | galasy; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | galmak 2; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 3; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 4; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 5; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 6; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 7; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 8; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 9; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | ph 10; Memes: 25 ° C. | (1) ACD |
| Köpçülikleýin çözelbet | 4.7 x 10-6 g / l | Siňdirilmedik suw ph ph 7.00; Memes: 25 ° C. | (1) ACD |
| Mollar içerki çözgüt | 7.3 x 10-9 mol / l | Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | galasy; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | galmak 2; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 3; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 4; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 5; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 6; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 7; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 8; Memes: 25 ° C. | (1) ACD |
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 9; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | ph 10; Memes: 25 ° C. | (1) ACD |
| Molar selubkasy | 7.3 x 10-9 mol / l | Siňdirilmedik suw ph ph 7.00; Memes: 25 ° C. | (1) ACD |
| Molekulýar agramy | 641.75 | ||
| pka | 14.50 ± 0.40 | "Kisidik temp: 25 ° C. | (1) ACD |
| pka | -3.24 ± 0.60 | Esasy temp: 25 ° C. | (1) ACD |
| Bug basyşy | 7.42 x 10-25 torr | Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Dykyzlygy
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Dykyzlygy | 1.237 ± 0.06 G / CM3 | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
| Woll nukagly | 518.4 ± ± 3.0 CM3 / mool | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Lipinski
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Erkin aýlanýan baglanyşyklar | 12 | (1) ACD | |
| H. | 7 | (1) ACD | |
| H donorlar | 1 | (1) ACD | |
| H donor / kabul ediji jem | 8 | (1) ACD | |
| dilim | 8.289 ± 0.729 | Memes: 25 ° C. | (1) ACD |
| Molekulýar agramy | 641.75 |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Gurluşy
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Polýar ýer meýdany | 77.5 A2 | (1) ACD | |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Termylal
| Emläk | Bahasy | Ýagdaýy | Çeşme |
| Gaýnatmak nokady | 768.7 ± 60.0 ° C. | MEKDEB: 760 torr | (1) ACD |
| Buglygyň ýanynda | 117.42 ± 3.0 kj / mol | MEKDEB: 760 torr | (1) ACD |
| Fleşko nokat | 418.7 ± 32.9 ° C.9 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Spektrler bar
1H nmr
13C nmr
