N-(4-bromophenyl)-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-bromophenyl)-3-[7-(3,4-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide
N-(4-bromophenyl)-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: | G298-0288 |
| Compound Name: | N-(4-bromophenyl)-3-[7-(3,4-dimethylphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide |
| Molecular Weight: | 466.34 |
| Molecular Formula: | C22 H20 Br N5 O2 |
| Smiles: | Cc1ccc(cc1C)N1C=Cn2c(CCC(Nc3ccc(cc3)[Br])=O)nnc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0217 |
| logD: | 3.0215 |
| logSw: | -3.2462 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.246 |
| InChI Key: | NZFHISMIVOPCHD-UHFFFAOYSA-N |