N-(2,5-dimethylphenyl)-2-({5-[(4-fluorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,5-dimethylphenyl)-2-({5-[(4-fluorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(2,5-dimethylphenyl)-2-({5-[(4-fluorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y205-6552 |
| Compound Name: | N-(2,5-dimethylphenyl)-2-({5-[(4-fluorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 400.47 |
| Molecular Formula: | C20 H21 F N4 O2 S |
| Smiles: | Cc1ccc(C)c(c1)NC(CSc1nnc(COc2ccc(cc2)F)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7033 |
| logD: | 2.7033 |
| logSw: | -2.9457 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.978 |
| InChI Key: | WZPNHTFMQODIRS-UHFFFAOYSA-N |