HIT ID: HIT100405481

Cas No: 39243-02-2

分子式: C16H12BrN5

分子量: 354.211

常用名: 12-bromo-3-methyl-9-(pyridin-2-yl)-2,4,5,8-tetraazatricyclo[8.4.0.0^{2,6}]tetradeca-1(10),3,5,8,11,13-hexaene, Pyrazolam

氢键受体数 (HBA): 4

氢键供体数 (HBD): 2

LogP: 1.30

IUPAC: 12-bromo-3-methyl-9-(pyridin-2-yl)-2,4,5,8-tetraazatricyclo[8.4.0.0^{2,6}]tetradeca-1(10),3,5,8,11,13-hexaene

SMILES: Cc1nnc2CN=C(c3ccccn3)c3cc(Br)ccc3-n12 |t:6|

InChI key: BGRWSFIQQPVEML-UHFFFAOYSA-N