N-methyl-N-propyl-2-[({5-(thiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-methyl-N-propyl-2-[({5-(thiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
N-methyl-N-propyl-2-[({5-(thiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V014-0144 |
| Compound Name: | N-methyl-N-propyl-2-[({5-(thiophen-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 516.61 |
| Molecular Formula: | C25 H23 F3 N4 O S2 |
| Salt: | not_available |
| Smiles: | CCCN(C)C(c1ccccc1CSc1nnc(c2cccs2)n1c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0266 |
| logD: | 6.0265 |
| logSw: | -5.6292 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.131 |
| InChI Key: | BGZDEIHMUDDUIU-UHFFFAOYSA-N |