N-(4-bromophenyl)-3-[7-(4-methoxyphenyl)-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-(4-methoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide
N-(4-bromophenyl)-3-[7-(4-methoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide
Compound characteristics
| Compound ID: | G298-0420 |
| Compound Name: | N-(4-bromophenyl)-3-[7-(4-methoxyphenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]propanamide |
| Molecular Weight: | 468.31 |
| Molecular Formula: | C21 H18 Br N5 O3 |
| Smiles: | COc1ccc(cc1)N1C=Cn2c(CCC(Nc3ccc(cc3)[Br])=O)nnc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.8564 |
| logD: | 1.8562 |
| logSw: | -2.4498 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.79 |
| InChI Key: | MLQDDDKMGZAFJK-UHFFFAOYSA-N |