N-[(furan-2-yl)methyl]-3-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-3-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
N-[(furan-2-yl)methyl]-3-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V030-6914 |
| Compound Name: | N-[(furan-2-yl)methyl]-3-[({5-methyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 472.49 |
| Molecular Formula: | C23 H19 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1nnc(n1c1cccc(c1)C(F)(F)F)SCc1cccc(c1)C(NCc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3285 |
| logD: | 4.3283 |
| logSw: | -4.3761 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.923 |
| InChI Key: | LCWIJJGMTHJFGU-UHFFFAOYSA-N |