4-(4-chlorophenyl)-N-(2-{[3-(2-methylpropyl)-1H-1,2,4-triazol-5-yl]amino}-2-oxoethyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-(4-chlorophenyl)-N-(2-{[3-(2-methylpropyl)-1H-1,2,4-triazol-5-yl]amino}-2-oxoethyl)piperazine-1-carboxamide
4-(4-chlorophenyl)-N-(2-{[3-(2-methylpropyl)-1H-1,2,4-triazol-5-yl]amino}-2-oxoethyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6582 |
| Compound Name: | 4-(4-chlorophenyl)-N-(2-{[3-(2-methylpropyl)-1H-1,2,4-triazol-5-yl]amino}-2-oxoethyl)piperazine-1-carboxamide |
| Molecular Weight: | 419.91 |
| Molecular Formula: | C19 H26 Cl N7 O2 |
| Smiles: | CC(C)Cc1nc(NC(CNC(N2CCN(CC2)c2ccc(cc2)[Cl])=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7649 |
| logD: | 2.7571 |
| logSw: | -3.5117 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.62 |
| InChI Key: | MLCMDEJGLXZHCS-UHFFFAOYSA-N |