3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-methoxyphenyl)benzamide
Chemical Structure Depiction of
3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-methoxyphenyl)benzamide
3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-methoxyphenyl)benzamide
Compound characteristics
| Compound ID: | V030-0418 |
| Compound Name: | 3-({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-(4-methoxyphenyl)benzamide |
| Molecular Weight: | 512.59 |
| Molecular Formula: | C28 H24 N4 O4 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)NC(c1cccc(CSc2nnc(c3ccco3)n2c2ccc(cc2)OC)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1493 |
| logD: | 5.1488 |
| logSw: | -5.1114 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.47 |
| InChI Key: | UWNDHZGWRRSSLG-UHFFFAOYSA-N |