4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Chemical Structure Depiction of
4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide
Compound characteristics
| Compound ID: | V026-6340 |
| Compound Name: | 4-({[5-(furan-2-yl)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-methyl-N-propylbenzamide |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C25 H26 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCCN(C)C(c1ccc(CSc2nnc(c3ccco3)n2c2ccccc2OC)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5674 |
| logD: | 3.5671 |
| logSw: | -3.7373 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.021 |
| InChI Key: | IBGMHYDMIFVNNS-UHFFFAOYSA-N |