N-{4-[chloro(difluoro)methoxy]phenyl}-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-{4-[chloro(difluoro)methoxy]phenyl}-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-{4-[chloro(difluoro)methoxy]phenyl}-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8015-1290 |
| Compound Name: | N-{4-[chloro(difluoro)methoxy]phenyl}-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 425.84 |
| Molecular Formula: | C17 H14 Cl F2 N5 O2 S |
| Smiles: | Cn1c(c2cccnc2)nnc1SCC(Nc1ccc(cc1)OC(F)(F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7219 |
| logD: | 2.6879 |
| logSw: | -3.7962 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.215 |
| InChI Key: | LPMQJMGXHRHCRZ-UHFFFAOYSA-N |