[1-(3-chlorophenyl)-5-phenyl-1H-1,2,4-triazol-3-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[1-(3-chlorophenyl)-5-phenyl-1H-1,2,4-triazol-3-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone
[1-(3-chlorophenyl)-5-phenyl-1H-1,2,4-triazol-3-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | D351-2207 |
| Compound Name: | [1-(3-chlorophenyl)-5-phenyl-1H-1,2,4-triazol-3-yl][4-(2-hydroxyethyl)piperazin-1-yl]methanone |
| Molecular Weight: | 411.89 |
| Molecular Formula: | C21 H22 Cl N5 O2 |
| Smiles: | C1CN(CCN1CCO)C(c1nc(c2ccccc2)n(c2cccc(c2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9918 |
| logD: | 2.9666 |
| logSw: | -3.2779 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.984 |
| InChI Key: | AAZNTLZITKHNTB-UHFFFAOYSA-N |