N-[(4-chlorophenyl)methyl]-4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide
N-[(4-chlorophenyl)methyl]-4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide
Compound characteristics
| Compound ID: | G423-0368 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-4-[7-(3,4-difluorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]butanamide |
| Molecular Weight: | 457.87 |
| Molecular Formula: | C22 H18 Cl F2 N5 O2 |
| Smiles: | C(CC(NCc1ccc(cc1)[Cl])=O)Cc1nnc2C(N(C=Cn12)c1ccc(c(c1)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8865 |
| logD: | 1.8865 |
| logSw: | -2.9838 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.568 |
| InChI Key: | ALBXCFMDIWPUQC-UHFFFAOYSA-N |