N-ethyl-2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
N-ethyl-2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
N-ethyl-2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | G199-1529 |
| Compound Name: | N-ethyl-2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 449.53 |
| Molecular Formula: | C23 H23 N5 O3 S |
| Smiles: | CCN(C(CSC1=NC(c2ccc(cc2)OC)=NC2=CC(NN12)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.635 |
| logD: | 3.635 |
| logSw: | -3.8552 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.568 |
| InChI Key: | MVUWFTJMQVORJD-UHFFFAOYSA-N |