2-({5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-methyl-N-phenylacetamide
Chemical Structure Depiction of
2-({5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-methyl-N-phenylacetamide
2-({5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-methyl-N-phenylacetamide
Compound characteristics
| Compound ID: | L849-0660 |
| Compound Name: | 2-({5-[3-(3-methoxyphenyl)-1-methyl-1H-pyrazol-4-yl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-methyl-N-phenylacetamide |
| Molecular Weight: | 448.55 |
| Molecular Formula: | C23 H24 N6 O2 S |
| Smiles: | CN(C(CSc1nnc(c2cn(C)nc2c2cccc(c2)OC)n1C)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4279 |
| logD: | 2.4279 |
| logSw: | -2.852 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.792 |
| InChI Key: | XEGOVUYPQNQRBC-UHFFFAOYSA-N |