[4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V005-0666 |
| Compound Name: | [4-({[5-(2-chlorophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 489.04 |
| Molecular Formula: | C27 H25 Cl N4 O S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)n1c(c2ccccc2[Cl])nnc1SCc1ccc(cc1)C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4362 |
| logD: | 5.4362 |
| logSw: | -5.68 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.727 |
| InChI Key: | RTUSEPARLQPZRZ-UHFFFAOYSA-N |