N-butyl-2-{[9-(2,5-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methylacetamide
Chemical Structure Depiction of
N-butyl-2-{[9-(2,5-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methylacetamide
N-butyl-2-{[9-(2,5-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methylacetamide
Compound characteristics
| Compound ID: | F831-0966 |
| Compound Name: | N-butyl-2-{[9-(2,5-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-methylacetamide |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C22 H26 N6 O S |
| Smiles: | CCCCN(C)C(CSc1nnc2c3cc(c4cc(C)ccc4C)nn3ccn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2578 |
| logD: | 3.2305 |
| logSw: | -3.2441 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.453 |
| InChI Key: | SRJCBSXUGQXYTN-UHFFFAOYSA-N |