4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(1H-1,2,4-triazol-5-yl)amino]ethyl}piperazine-1-carboxamide
Chemical Structure Depiction of
4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(1H-1,2,4-triazol-5-yl)amino]ethyl}piperazine-1-carboxamide
4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(1H-1,2,4-triazol-5-yl)amino]ethyl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6587 |
| Compound Name: | 4-(3,4-dichlorophenyl)-N-{2-oxo-2-[(1H-1,2,4-triazol-5-yl)amino]ethyl}piperazine-1-carboxamide |
| Molecular Weight: | 398.25 |
| Molecular Formula: | C15 H17 Cl2 N7 O2 |
| Smiles: | C(C(Nc1ncn[nH]1)=O)NC(N1CCN(CC1)c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.5936 |
| logD: | 1.5864 |
| logSw: | -2.618 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.277 |
| InChI Key: | FPXQAWKAYVFUGM-UHFFFAOYSA-N |