主记录
BCPP000147
- CAS
- 152946-68-4
- PubChem CID
- 57345766
- SMILES
- CC1=C(C2=C(C=C1)N=C(NC2=C)N)SC3=CC=NC=C3
- 分子式
- C15H14N4S
- 分子量
- 282.372
- 精确分子量
- 282.0939
- InChI
- InChI=1S/C15H14N4S/c1-9-3-4-12-13(10(2)18-15(16)19-12)14(9)20-11-5-7-17-8-6-11/h3-8H,2H2,1H3,(H3,16,18,19)
- InChIKey
- SKHWBFVENMXXSG-UHFFFAOYSA-N
- LogP
- 3.0613
- TPSA
- 63.3
名称与别名
- BCPP000147
- BCP9000992
- 152946-68-4