主记录
Ponesimod
- CAS
- 854107-55-4
- PubChem CID
- 11363176
- SMILES
- CCCN=C1N(C(=O)/C(=C/C2=CC(=C(C=C2)OC[C@@H](CO)O)Cl)/S1)C3=CC=CC=C3C
- 分子式
- C23H25ClN2O4S
- 分子量
- 460.983
- 精确分子量
- 460.1224
- InChI
- InChI=1S/C23H25ClN2O4S/c1-3-10-25-23-26(19-7-5-4-6-15(19)2)22(29)21(31-23)12-16-8-9-20(18(24)11-16)30-14-17(28)13-27/h4-9,11-12,17,27-28H,3,10,13-14H2,1-2H3/b21-12-,25-23?/t17-/m1/s1
- InChIKey
- LPAUOXUZGSBGDU-ULCCENQXSA-N
- LogP
- 4.2673
- TPSA
- 82.36
名称与别名
- Ponesimod
- Ponvory
- 854107-55-4
- Ponesimod [INN]
- Ponvory (TN)
- ACT-128800
- Ponesimod [USAN:INN]
- UNII-5G7AKV2MKP
- 5G7AKV2MKP
- Ponesimod (USAN/INN)
- PONESIMOD [USAN]
- PONESIMOD [WHO-DD]
- Ponesimod,ACT-128800
- C23H25ClN2O4S
- CHEMBL1096146
- GTPL9320
- orb1304376
- Ponesimod (ACT-128800)
- PONESIMOD [ORANGE BOOK]
- SCHEMBL15477934
- SCHEMBL29355025
- SCHEMBL29455088
- SCHEMBL30817431
- SCHEMBL31570191
- DTXSID50234631
- ACT128800
- CHEBI:233412
- MFCD18207776
- GLXC-10788
- ACT 128800