主记录
Verubecestat
- CAS
- 1286770-55-5
- PubChem CID
- 51352361
- SMILES
- C[C@]1(CS(=O)(=O)N(C(=N1)N)C)C2=C(C=CC(=C2)NC(=O)C3=NC=C(C=C3)F)F
- 分子式
- C17H17F2N5O3S
- 分子量
- 409.418
- 精确分子量
- 409.102
- InChI
- InChI=1S/C17H17F2N5O3S/c1-17(9-28(26,27)24(2)16(20)23-17)12-7-11(4-5-13(12)19)22-15(25)14-6-3-10(18)8-21-14/h3-8H,9H2,1-2H3,(H2,20,23)(H,22,25)/t17-/m0/s1
- InChIKey
- YHYKUSGACIYRML-KRWDZBQOSA-N
- LogP
- 1.4172
- TPSA
- 117.75
名称与别名
- Verubecestat
- 1286770-55-5
- verubecestatum
- Verubecestat Free Base
- MK-8931
- VerubecestatFreeBase
- Verubecestat [USAN]
- Verubecestat (MK-8931)
- J1I0P6WT7T
- Verubecestat [USAN:INN]
- UNII-J1I0P6WT7T
- RefChem:901821
- C17H17F2N5O3S
- VERUBECESTAT [INN]
- VERUBECESTAT [JAN]
- Verubecestat; MK-8931
- D0R4KK
- SCH-900931
- SCH900931
- SCH 900931
- VERUBECESTAT [WHO-DD]
- MFCD28963974
- DTXSID301020622
- GTPL8699
- orb1300146
- Verubecestat (JAN/USAN/INN)
- example 25 (US8940748)
- CHEMBL3301601
- SCHEMBL10328722
- SCHEMBL17507398