N-(2-bromo-4-methylphenyl)-2-{8-[methyl(propyl)amino]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Chemical Structure Depiction of
N-(2-bromo-4-methylphenyl)-2-{8-[methyl(propyl)amino]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
N-(2-bromo-4-methylphenyl)-2-{8-[methyl(propyl)amino]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Compound characteristics
| Compound ID: | M460-4870 |
| Compound Name: | N-(2-bromo-4-methylphenyl)-2-{8-[methyl(propyl)amino]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide |
| Molecular Weight: | 433.31 |
| Molecular Formula: | C18 H21 Br N6 O2 |
| Smiles: | CCCN(C)C1C2=NN(CC(Nc3ccc(C)cc3[Br])=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2293 |
| logD: | 2.2293 |
| logSw: | -2.8105 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.263 |
| InChI Key: | XQKLYLKLNCTDCP-UHFFFAOYSA-N |