N-[(4-chlorophenyl)methyl]-3-[7-(3,4-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-3-[7-(3,4-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide
N-[(4-chlorophenyl)methyl]-3-[7-(3,4-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide
Compound characteristics
| Compound ID: | G298-0292 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-3-[7-(3,4-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide |
| Molecular Weight: | 435.91 |
| Molecular Formula: | C23 H22 Cl N5 O2 |
| Smiles: | Cc1ccc(cc1C)N1C=Cn2c(CCC(NCc3ccc(cc3)[Cl])=O)nnc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.4828 |
| logD: | 2.4828 |
| logSw: | -3.4187 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.568 |
| InChI Key: | ODPJKAXOMGYNJX-UHFFFAOYSA-N |