N-(3,4-dimethoxyphenyl)-4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
N-(3,4-dimethoxyphenyl)-4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | V028-1960 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-4-({[4-(2-fluorophenyl)-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 530.58 |
| Molecular Formula: | C28 H23 F N4 O4 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1OC)NC(c1ccc(CSc2nnc(c3ccco3)n2c2ccccc2F)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.381 |
| logD: | 4.3793 |
| logSw: | -4.3469 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.342 |
| InChI Key: | CARWDNCPXGNPJL-UHFFFAOYSA-N |