N-(3,3-diphenylpropyl)-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-(3,3-diphenylpropyl)-2-({[4-(2-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide
N-(3,3-diphenylpropyl)-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: | V010-1502 |
| Compound Name: | N-(3,3-diphenylpropyl)-2-({[4-(2-methoxyphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 618.78 |
| Molecular Formula: | C34 H30 N6 O2 S2 |
| Salt: | not_available |
| Smiles: | COc1ccccc1n1c(c2ccncc2)nnc1SCc1nc(cs1)C(NCCC(c1ccccc1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3627 |
| logD: | 6.3623 |
| logSw: | -5.4727 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.954 |
| InChI Key: | BOBUKFNIFZRMJE-UHFFFAOYSA-N |