2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide
2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
Compound ID: | G199-1799 |
Compound Name: | 2-{[2-(furan-2-yl)-7-oxo-6,7-dihydropyrazolo[1,5-a][1,3,5]triazin-4-yl]sulfanyl}-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]acetamide |
Molecular Weight: | 431.49 |
Molecular Formula: | C17 H17 N7 O3 S2 |
Smiles: | CC(C)Cc1nnc(NC(CSC2=NC(c3ccco3)=NC3=CC(NN23)=O)=O)s1 |
Stereo: | ACHIRAL |
logP: | 2.2625 |
logD: | 2.2334 |
logSw: | -2.7362 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 105.701 |
InChI Key: | LTXQVFJKSDBMHA-UHFFFAOYSA-N |