2-{[2-(2-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-{[2-(2-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
2-{[2-(2-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-phenylpropyl)acetamide
Compound characteristics
Compound ID: | G199-2975 |
Compound Name: | 2-{[2-(2-methylphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-phenylpropyl)acetamide |
Molecular Weight: | 433.53 |
Molecular Formula: | C23 H23 N5 O2 S |
Smiles: | Cc1ccccc1C1=NC2=CC(NN2C(=N1)SCC(NCCCc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.3891 |
logD: | 3.3891 |
logSw: | -3.8213 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.246 |
InChI Key: | CJRGIXLOMZAWJR-UHFFFAOYSA-N |