2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide
2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | G199-3401 |
| Compound Name: | 2-{[2-(4-methoxyphenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 401.49 |
| Molecular Formula: | C19 H23 N5 O3 S |
| Smiles: | CC(C)CCNC(CSC1=NC(c2ccc(cc2)OC)=NC2=CC(NN12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2545 |
| logD: | 2.2545 |
| logSw: | -2.6007 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.061 |
| InChI Key: | VCDYZXQKNBIBER-UHFFFAOYSA-N |