[4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Chemical Structure Depiction of
[4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
[4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V025-5701 |
| Compound Name: | [4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](4-methylpiperazin-1-yl)methanone |
| Molecular Weight: | 518.08 |
| Molecular Formula: | C28 H28 Cl N5 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2ccccc2[Cl])nnc1SCc1ccc(cc1)C(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5416 |
| logD: | 4.4109 |
| logSw: | -4.5147 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.837 |
| InChI Key: | LUNHAQUBKURQSR-UHFFFAOYSA-N |