C21h211N3O6 titiin, α - [1-Nafthallllll) amino - α -oxo- (aci)
CAC Hasaba alyş belgisi
1262015-90-60-6
Esasy fiziki aýratynlyklary | Bahasy | Ýagdaýy |
Molekulýar agramy | 411.41 | - |
Dykyzlygy (çak edilýär) | 1.460 ± 0.06 g / cm3 | Bu bellik: 20 ° C; MEKDEB: 760 torr |
pka (çak edilýär) | 8.23 ± 0.10 | "Kisidik temp: 25 ° C. |
Kanoniki ýylgyryşlar
O = c1nc (= o) n (= o) ncc (= o) ncc (= o) ncc = cc = cc. cc = cc32) c4oc (Co) c (o) c4
ISOMICICK ýylgyrýar
O = c1n (c = c (c = c (ncc = c = cc = c / cc> c @ c @ c @ c @ c @ c @ h) [c @ c @
Inchi
Inçi = 1s / c21h21n3n3o6 / c25-15 7-96-185-26H, 8-9,11h2, (h, 22,27) (h, 23,28,27,28,28,28,28,21) / t16-2-, 17 +, 18 + / m0 / s1
Inchi açary
UudhoszzavihGtb-rccfbdps-n
Bu madda üçin başga-da beýleki atlar
α - [1-nafthallllikllllll) aminothimliimid) - α -oxotiiin (aci); (NAPDU); 87: Pn: Wo202008151015101510 SEQID: 87 talap edilýän yzygiderlilik
Elýeterli häsiýetler
Biologiki
Himiki
Dykyzlygy
Lipinski
Gurluşy
Emläk | Bahasy | Ýagdaýy | Çeşme |
Bionokententrasiýa faktory | 3.23 | galasy; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 3.23 | galmak 2; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 3.23 | ph 3; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 3.23 | ph 4; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 3.23 | ph 5; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 3.19 | ph 6; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 2.85 | ph 7; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.40 | ph 8; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.0 | ph 9; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1.0 | ph 10; Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Emläk bahasy |
KOK 80.5 PH 1; Memor: 25 ° C (1) ACD |
KOK 80.5 PH 2; Memor: 25 ° C (1) ACD |
KOK 80.5 PH 3; Memor: 25 ° C (1) ACD |
KOK 80.5 Ph 4; Memor: 25 ° C (1) ACD |
KOK 80,4 ph 5; Memor: 25 ° C (1) ACD |
KOK 79.5 p, 6; Memor: 25 ° C (1) ACD |
Koc 71,1 f pch 7; Memor: 25 ° C (1) ACD |
Koc 34,9 ph 8; Memor: 25 ° C (1) ACD |
KOK 6.35 Ph 9; Memor: 25 ° C (1) ACD |
KOK 1.39 Ph 10; Memor: 25 ° C (1) ACD |
/ logd 0,97 pla 1; Memor: 25 ° C (1) ACD |
/ surnald 0,97 ph 2; Memor: 25 ° C (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
surnal | 0.97 | ph 3; Memes: 25 ° C. | (1) ACD |
surnal | 0.97 | ph 4; Memes: 25 ° C. | (1) ACD |
surnal | 0.97 | ph 5; Memes: 25 ° C. | (1) ACD |
surnal | 0.97 | ph 6; Memes: 25 ° C. | (1) ACD |
surnal | 0.92 | ph 7; Memes: 25 ° C. | (1) ACD |
surnal | 0.61 | ph 8; Memes: 25 ° C. | (1) ACD |
surnal | -0.13 | ph 9; Memes: 25 ° C. | (1) ACD |
surnal | -0.79 | ph 10; Memes: 25 ° C. | (1) ACD |
dilim | 0.973 ± 0.586 | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin gitmek | 5.3 x 10-3 g / l | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | galasy; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | ph 3; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | ph 4; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | ph 5; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | ph 6; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.8 x 10-3 g / l | ph 7; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 0.012 g / l | ph 8; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 0.066 g / l | ph 9; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 0.30 g / l | ph 10; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.3 x 10-3 g / l | Uncuffuffed Suw, 6,37; Memes: 25 ° C. | (1) ACD |
Mollar içerki çözgüt | 1.3 x 10-5 mol / l | Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.3 x 10-5 mol / l | galasy; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.3 x 10-5 mol / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.3 x 10-5 mol / l | ph 3; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.3 x 10-5 mol / l | ph 4; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.3 x 10-5 mol / l | ph 5; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.3 x 10-5 mol / l | ph 6; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.4 x 10-5 mol / l | ph 7; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.9 x 10-5 mol / l | ph 8; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.6 x 10-4 mol / l | ph 9; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 7.4 x 10-4 mol / l | ph 10; Memes: 25 ° C. | (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
Molar selubkasy | 1.3 x 10-5 mol / l | Uncuffuffed Suw, 6,37; Memes: 25 ° C. | (1) ACD |
Molekulýar agramy | 411.41 | ||
pka | 8.23 ± 0.10 | "Kisidik temp: 25 ° C. | (1) ACD |
pka | -1.90 ± 0.20 | Esasy temp: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Emläk | Bahasy | Ýagdaýy | Çeşme |
Dykyzlygy | 1.460 ± 0.06 g / cm3 | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
Woll nukagly | 281.6 ± 3.0 Cm3 / mol | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Emläk | Bahasy | Ýagdaýy | Çeşme |
Erkin aýlanýan baglanyşyklar | 7 | (1) ACD | |
H. | 9 | (1) ACD | |
H donorlar | 4 | (1) ACD | |
H donor / kabul ediji jem | 13 | (1) ACD | |
dilim | 0.973 ± 0.586 | Memes: 25 ° C. | (1) ACD |
Molekulýar agramy | 411.41 |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Emläk | Bahasy | Ýagdaýly çeşme |
Polýar ýer meýdany | 128 A2 | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Spektrler bar
1 h nmr
13 c nmr