N-(4-butylphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Chemical Structure Depiction of
N-(4-butylphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
N-(4-butylphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide
Compound characteristics
| Compound ID: | M460-4067 |
| Compound Name: | N-(4-butylphenyl)-2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}acetamide |
| Molecular Weight: | 499.62 |
| Molecular Formula: | C28 H33 N7 O2 |
| Smiles: | CCCCc1ccc(cc1)NC(CN1C(N2C=CN=C(C2=N1)N1CCN(CC1)c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8037 |
| logD: | 4.8035 |
| logSw: | -4.4063 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.469 |
| InChI Key: | VAGZHFZJDZOOGK-UHFFFAOYSA-N |