N-(4-fluorophenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]butanamide
N-(4-fluorophenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | G802-0574 |
| Compound Name: | N-(4-fluorophenyl)-2-[(8-oxo-7-phenyl-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)sulfanyl]butanamide |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C21 H18 F N5 O2 S |
| Smiles: | CCC(C(Nc1ccc(cc1)F)=O)Sc1nnc2C(N(C=Cn12)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5925 |
| logD: | 2.5923 |
| logSw: | -3.0618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.065 |
| InChI Key: | KAZVRGFYTYJPIL-KRWDZBQOSA-N |