5-(difluoromethyl)-4-{[(2-methylphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(difluoromethyl)-4-{[(2-methylphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
5-(difluoromethyl)-4-{[(2-methylphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y508-9842 |
| Compound Name: | 5-(difluoromethyl)-4-{[(2-methylphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 268.28 |
| Molecular Formula: | C11 H10 F2 N4 S |
| Smiles: | Cc1ccccc1/C=N/n1c(C(F)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.0553 |
| logD: | 1.3095 |
| logSw: | -1.6751 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.35 |
| InChI Key: | FUFNGBDEKXVGAY-UHFFFAOYSA-N |