N-benzyl-2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
N-benzyl-2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V010-6440 |
| Compound Name: | N-benzyl-2-({[4-(3-chlorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 519.05 |
| Molecular Formula: | C25 H19 Cl N6 O S2 |
| Salt: | not_available |
| Smiles: | C(c1ccccc1)NC(c1csc(CSc2nnc(c3ccncc3)n2c2cccc(c2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0637 |
| logD: | 5.0637 |
| logSw: | -5.388 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.055 |
| InChI Key: | FXURXMICRXTTPZ-UHFFFAOYSA-N |