4-[({3-[chloro(difluoro)methyl]-5-sulfanyl-4H-1,2,4-triazol-4-yl}imino)methyl]phenol
Chemical Structure Depiction of
4-[({3-[chloro(difluoro)methyl]-5-sulfanyl-4H-1,2,4-triazol-4-yl}imino)methyl]phenol
4-[({3-[chloro(difluoro)methyl]-5-sulfanyl-4H-1,2,4-triazol-4-yl}imino)methyl]phenol
Compound characteristics
| Compound ID: | Y501-7499 |
| Compound Name: | 4-[({3-[chloro(difluoro)methyl]-5-sulfanyl-4H-1,2,4-triazol-4-yl}imino)methyl]phenol |
| Molecular Weight: | 304.7 |
| Molecular Formula: | C10 H7 Cl F2 N4 O S |
| Smiles: | C(\c1ccc(cc1)O)=N/n1c(C(F)(F)[Cl])nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.843 |
| logD: | 1.0972 |
| logSw: | -1.605 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.967 |
| InChI Key: | IQUOXPYJSFJFTM-UHFFFAOYSA-N |