主记录
Isavuconazole
- CAS
- 1176988-44-5
- PubChem CID
- 9932792
- SMILES
- C[C@H](C1=NC(=CS1)C2=CC=C(C=C2)C#N)[C@](CN3C=NC=N3)(C4=C(C=CC(=C4)F)F)O
- 分子式
- C22H17F2N5OS
- 分子量
- 437.475
- 精确分子量
- 437.1122
- InChI
- InChI=1S/C22H17F2N5OS/c1-14(21-28-20(10-31-21)16-4-2-15(9-25)3-5-16)22(30,11-29-13-26-12-27-29)18-8-17(23)6-7-19(18)24/h2-8,10,12-14,30H,11H2,1H3/t14-,22-/m1/s1
- InChIKey
- DDFOUSQFMYRUQK-JLCFBVMHSA-N
- LogP
- 4.243
- TPSA
- 87.62
名称与别名
- Isavuconazole
- Isavuconazole Impurity 24
- Isavuconazole Impurity 38
- Bal4815
- ISAVUCONAZOLE IMPURITY E
- B24ULD3D8X
- ZINC114882718
- ACN-048051
- CID9932792
- 1176988-44-5
- B4826
- B2694-064618
- 4-(2-((2S,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-4-(1H-1,2,4-triazol-1-yl)butan-2-yl)thiazol-4-yl)benzonitrile
- 4-[2-[(1S,2R)-2-(2,5-Difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]-4-thiazolyl]benzonitrile
- 241479-67-4
- 4-(2-((1S,2R)-2-(2,5-difluorophenyl)-3-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl)-4-thiazolyl)-benzonitrile
- 4-[2-[(2S,3R)-3-(2,5-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-1,3-thiazol-4-yl]benzonitrile
- Benzonitrile, 4-[2-[(1S,2R)-2-(2,5-difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl]-4-thiazolyl]-