N-(3-acetylphenyl)-2-({4-ethyl-5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-({4-ethyl-5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
N-(3-acetylphenyl)-2-({4-ethyl-5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | L849-0616 |
| Compound Name: | N-(3-acetylphenyl)-2-({4-ethyl-5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C25 H26 N6 O3 S |
| Smiles: | CCn1c(c2cn(C)nc2c2cccc(c2)OC)nnc1SCC(Nc1cccc(c1)C(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3417 |
| logD: | 3.3416 |
| logSw: | -3.5288 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.569 |
| InChI Key: | LCVGSJGHPUIPPB-UHFFFAOYSA-N |