N-hexyl-2-({[4-(2-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-hexyl-2-({[4-(2-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
N-hexyl-2-({[4-(2-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V007-8550 |
| Compound Name: | N-hexyl-2-({[4-(2-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 508.66 |
| Molecular Formula: | C25 H28 N6 O2 S2 |
| Salt: | not_available |
| Smiles: | CCCCCCNC(c1csc(CSc2nnc(c3ccncc3)n2c2ccccc2OC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9691 |
| logD: | 4.9688 |
| logSw: | -4.4633 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.497 |
| InChI Key: | LHRSXFVUPWYWQB-UHFFFAOYSA-N |