2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
Chemical Structure Depiction of
2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methoxypropyl)acetamide
Compound characteristics
Compound ID: | G199-3167 |
Compound Name: | 2-{[2-(2-fluorophenyl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-(3-methoxypropyl)acetamide |
Molecular Weight: | 391.42 |
Molecular Formula: | C17 H18 F N5 O3 S |
Smiles: | COCCCNC(CSC1=NC(c2ccccc2F)=NC2=CC(NN12)=O)=O |
Stereo: | ACHIRAL |
logP: | 0.8596 |
logD: | 0.8596 |
logSw: | -2.2735 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 82.86 |
InChI Key: | GKMHSLJMQVDFMN-UHFFFAOYSA-N |