Cas no 1401238-97-8 (Azacitidine)
Azacitidine structure
Product Name:Azacitidine
CAS No:1401238-97-8
MF:C8H12N4O5
MW:244.204681396484
CID:5100381
Update Time:2023-08-25
Azacitidine Chemical and Physical Properties
Names and Identifiers
-
- 5-azacytidine
- Azacitidine
- Ladakamycin
- Azacytidine
- Vidaza
- Mylosar
- 5-azacitidine
- Azacitidinum
- Azacitidina
- Azacitidinum [INN-Latin]
- 5-AZAC
- Azacitidina [INN-Spanish]
- 4-Amino-1-beta-D-ribofuranosyl-s-triazin-2(1H)-one
- NSC102816
- 5AzaC
- 4-Amino-1-beta-d-ribofuranosyl-1,3,5-triazin-2(1H)-one
- Antibiotic U 18496
- 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1,3,5-triazin-2(1H)-one
- M801H13NRU
- 4-Amino-1-(beta-D-ribofuranosyl)-1
-
- Inchi： 1S/C8H12N4O5/c9-7-10-2-12(8(16)11-7)6-5(15)4(14)3(1-13)17-6/h2-6,13-15H,1H2,(H2,9,11,16)/t3-,4-,5-,6-/m1/s1
- InChI Key： NMUSYJAQQFHJEW-KVTDHHQDSA-N
- SMILES： O1[C@H]([C@@H]([C@@H]([C@H]1CO)O)O)N1C=NC(N)=NC1=O
Computed Properties
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 384
- XLogP3: -2.2
- Topological Polar Surface Area: 141
Azacitidine Related Literature
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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