4-ethyl-5-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-ethyl-5-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
4-ethyl-5-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y503-2176 |
| Compound Name: | 4-ethyl-5-{3-[(2,2,3,3-tetrafluoropropoxy)methyl]phenyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 349.35 |
| Molecular Formula: | C14 H15 F4 N3 O S |
| Smiles: | CCn1c(c2cccc(COCC(C(F)F)(F)F)c2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 3.0869 |
| logD: | 2.7425 |
| logSw: | -3.0999 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.145 |
| InChI Key: | DAQKBVYNUTUNDT-UHFFFAOYSA-N |