ethyl 2-[({5-benzyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
ethyl 2-[({5-benzyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,3-thiazole-4-carboxylate
ethyl 2-[({5-benzyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | V014-1057 |
| Compound Name: | ethyl 2-[({5-benzyl-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 504.55 |
| Molecular Formula: | C23 H19 F3 N4 O2 S2 |
| Salt: | not_available |
| Smiles: | CCOC(c1csc(CSc2nnc(Cc3ccccc3)n2c2cccc(c2)C(F)(F)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4789 |
| logD: | 5.4789 |
| logSw: | -5.5466 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.943 |
| InChI Key: | LVUVJBOGKVOJHD-UHFFFAOYSA-N |