N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V025-4501 |
| Compound Name: | N-(4-methoxyphenyl)-4-({[4-(2-methylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 507.61 |
| Molecular Formula: | C29 H25 N5 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1n1c(c2ccncc2)nnc1SCc1ccc(cc1)C(Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0355 |
| logD: | 5.0353 |
| logSw: | -4.4502 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.475 |
| InChI Key: | VGCSAGPMEOBLKX-UHFFFAOYSA-N |