[2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
[2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | V029-8490 |
| Compound Name: | [2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)phenyl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 476 |
| Molecular Formula: | C25 H22 Cl N5 O S |
| Salt: | not_available |
| Smiles: | C1CCN(C1)C(c1ccccc1CSc1nnc(c2ccncc2)n1c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7319 |
| logD: | 4.7319 |
| logSw: | -4.9957 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.155 |
| InChI Key: | SQDXIGUUNTWAQU-UHFFFAOYSA-N |