4-{[(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]amino}-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-{[(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]amino}-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
4-{[(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]amino}-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 6143-0087 |
| Compound Name: | 4-{[(1-methyl-1,2,3,4-tetrahydroquinolin-6-yl)methylidene]amino}-5-(trifluoromethyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 341.36 |
| Molecular Formula: | C14 H14 F3 N5 S |
| Smiles: | CN1CCCc2cc(/C=N/n3c(C(F)(F)F)nnc3S)ccc12 |
| Stereo: | ACHIRAL |
| logP: | 1.9735 |
| logD: | 1.2277 |
| logSw: | -2.1877 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.9 |
| InChI Key: | NMRQPQQGVMBAJQ-UHFFFAOYSA-N |