5-(difluoromethyl)-4-[({4-methoxy-3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(difluoromethyl)-4-[({4-methoxy-3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
5-(difluoromethyl)-4-[({4-methoxy-3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y508-9989 |
| Compound Name: | 5-(difluoromethyl)-4-[({4-methoxy-3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}methylidene)amino]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 428.35 |
| Molecular Formula: | C15 H14 F6 N4 O2 S |
| Smiles: | COc1ccc(/C=N/n2c(C(F)F)nnc2S)cc1COCC(C(F)F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.2558 |
| logD: | 1.51 |
| logSw: | -2.5609 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.415 |
| InChI Key: | IRHZSCJSNMKRCP-UHFFFAOYSA-N |