4-bromo-3-({[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
Chemical Structure Depiction of
4-bromo-3-({[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
4-bromo-3-({[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol
Compound characteristics
| Compound ID: | Y500-8690 |
| Compound Name: | 4-bromo-3-({[3-sulfanyl-5-(trifluoromethyl)-4H-1,2,4-triazol-4-yl]imino}methyl)phenol |
| Molecular Weight: | 367.14 |
| Molecular Formula: | C10 H6 Br F3 N4 O S |
| Smiles: | C(\c1cc(ccc1[Br])O)=N/n1c(C(F)(F)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.5044 |
| logD: | 1.7586 |
| logSw: | -1.9854 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.967 |
| InChI Key: | OOKDCMWGQIXJLD-UHFFFAOYSA-N |