主记录
MONTELUKAST SODIUM
- CAS
- 151767-02-1
- PubChem CID
- 9916882
- SMILES
- CC(C)(C1=CC=CC=C1CC[C@H](C2=CC=CC(=C2)/C=C/C3=NC4=C(C=CC(=C4)Cl)C=C3)SCC5(CC5)CC(=O)O)O.[Na]
- 分子式
- C35H36ClNNaO3S
- 分子量
- 609.187
- 精确分子量
- 608.2002
- InChI
- InChI=1S/C35H36ClNO3S.Na/c1-34(2,40)30-9-4-3-7-25(30)13-17-32(41-23-35(18-19-35)22-33(38)39)27-8-5-6-24(20-27)10-15-29-16-12-26-11-14-28(36)21-31(26)37-29;/h3-12,14-16,20-21,32,40H,13,17-19,22-23H2,1-2H3,(H,38,39);/b15-10+;/t32-;/m1./s1
- InChIKey
- ZMFQNQCXWQXCFO-HKHDRNBDSA-N
- LogP
- 8.5672
- TPSA
- 70.42
名称与别名
- MONTELUKAST SODIUM
- Montelukast sodium hydrate
- AKOS037643272
- CID9916882
- CID 9916882
- 767M021
- 151767-02-1
- Cyclopropaneacetic acid, 1-[[[(1R)-1-[3-[(1E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-3-[2-(1-hydroxy-1-methylethyl)phenyl]propyl]thio]methyl]-, sodium salt (1:1)