N-hexyl-2-({[5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-hexyl-2-({[5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
N-hexyl-2-({[5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | V001-3960 |
| Compound Name: | N-hexyl-2-({[5-(3-methoxyphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 521.7 |
| Molecular Formula: | C27 H31 N5 O2 S2 |
| Salt: | not_available |
| Smiles: | CCCCCCNC(c1csc(CSc2nnc(c3cccc(c3)OC)n2c2ccc(C)cc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9251 |
| logD: | 6.9251 |
| logSw: | -5.5172 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.283 |
| InChI Key: | JRIMSKPNPVSXOA-UHFFFAOYSA-N |