N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide
N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide
Compound characteristics
| Compound ID: | G423-0552 |
| Compound Name: | N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide |
| Molecular Weight: | 439.88 |
| Molecular Formula: | C22 H19 Cl F N5 O2 |
| Smiles: | CC(CC(Nc1ccc(cc1)[Cl])=O)Cc1nnc2C(N(C=Cn12)c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8378 |
| logD: | 2.8375 |
| logSw: | -3.5245 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.246 |
| InChI Key: | KPOZYCXJPBIAHZ-CQSZACIVSA-N |