[4-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[4-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[4-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V027-6357 |
| Compound Name: | [4-({[5-(2-chlorophenyl)-4-(3-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 509.46 |
| Molecular Formula: | C26 H22 Cl2 N4 O S |
| Salt: | not_available |
| Smiles: | C1CCN(C1)C(c1ccc(CSc2nnc(c3ccccc3[Cl])n2c2cccc(c2)[Cl])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5773 |
| logD: | 5.5773 |
| logSw: | -5.754 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.727 |
| InChI Key: | HSCXAKFMOGVMHW-UHFFFAOYSA-N |