[4-(5-chloro-2-methylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone
Chemical Structure Depiction of
[4-(5-chloro-2-methylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone
[4-(5-chloro-2-methylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone
Compound characteristics
| Compound ID: | M031-0084 |
| Compound Name: | [4-(5-chloro-2-methylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone |
| Molecular Weight: | 395.89 |
| Molecular Formula: | C21 H22 Cl N5 O |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(c1ccc(Cn2cncn2)cc1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.8647 |
| logD: | 2.8647 |
| logSw: | -3.3955 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.823 |
| InChI Key: | MBBDLCADNFLJEM-UHFFFAOYSA-N |