2-[({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-N-methyl-N-propylbenzamide
Chemical Structure Depiction of
2-[({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-N-methyl-N-propylbenzamide
2-[({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-N-methyl-N-propylbenzamide
Compound characteristics
| Compound ID: | V025-9337 |
| Compound Name: | 2-[({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-N-methyl-N-propylbenzamide |
| Molecular Weight: | 500.54 |
| Molecular Formula: | C25 H23 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCCN(C)C(c1ccccc1CSc1nnc(c2ccco2)n1c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2557 |
| logD: | 5.2557 |
| logSw: | -5.0955 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.691 |
| InChI Key: | YTPZHHBXSQLCOZ-UHFFFAOYSA-N |