[4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone
Chemical Structure Depiction of
[4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone
[4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone
Compound characteristics
| Compound ID: | M031-0083 |
| Compound Name: | [4-(2,5-dimethylphenyl)piperazin-1-yl]{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}methanone |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C22 H25 N5 O |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc(Cn2cncn2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.74 |
| logD: | 2.74 |
| logSw: | -2.7241 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.823 |
| InChI Key: | MPMDAMUUJBASHA-UHFFFAOYSA-N |