N-(2-ethyl-6-methylphenyl)-2-{[2-(furan-2-yl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-{[2-(furan-2-yl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
N-(2-ethyl-6-methylphenyl)-2-{[2-(furan-2-yl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F424-0948 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-2-{[2-(furan-2-yl)-4-oxo-4,5-dihydropyrazolo[1,5-d][1,2,4]triazin-7-yl]sulfanyl}acetamide |
| Molecular Weight: | 409.47 |
| Molecular Formula: | C20 H19 N5 O3 S |
| Smiles: | CCc1cccc(C)c1NC(CSC1=NNC(c2cc(c3ccco3)nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0816 |
| logD: | 3.08 |
| logSw: | -3.0889 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.646 |
| InChI Key: | CSDHNSDMQJQJGI-UHFFFAOYSA-N |