主记录
Ensartinib hydrochloride
- CAS
- 2137030-98-7
- PubChem CID
- 132190581
- SMILES
- C[C@@H]1CN(C[C@@H](N1)C)C(=O)C2=CC=C(C=C2)NC(=O)C3=NN=C(C(=C3)O[C@H](C)C4=C(C=CC(=C4Cl)F)Cl)N.Cl
- 分子式
- C26H28Cl3FN6O3
- 分子量
- 597.906
- 精确分子量
- 596.1273
- InChI
- InChI=1S/C26H27Cl2FN6O3.ClH/c1-13-11-35(12-14(2)31-13)26(37)16-4-6-17(7-5-16)32-25(36)20-10-21(24(30)34-33-20)38-15(3)22-18(27)8-9-19(29)23(22)28;/h4-10,13-15,31H,11-12H2,1-3H3,(H2,30,34)(H,32,36);1H/t13-,14+,15-;/m1./s1
- InChIKey
- KFBKQZJZVWWQKO-USAYTKQKSA-N
- LogP
- 5.1412
- TPSA
- 122.47
名称与别名
- Ensartinib hydrochloride
- ENSARTINIB 2HCL
- C26H28Cl3FN6O3
- SCHEMBL19667950
- SCHEMBL30887834
- MFCD31657344
- 2137030-98-7
- 6-Amino-5-((R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy)-N-(4-((3S,5R)-3,5-dimethylpiperazine-1-carbonyl)phenyl)pyridazine-3-carboxamide hydrochloride
- 6-amino-5-[(1R)-1-(2,6-dichloro-3-fluoro-phenyl)ethoxy]-N-[4-[(3R,5S)-3,5-dimethylpiperazine-1-carbonyl]phenyl]pyridazine-3-carboxamide;hydrochloride