2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide
2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | F831-0871 |
| Compound Name: | 2-{[9-(3,4-dimethylphenyl)pyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-3-yl]sulfanyl}-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 448.57 |
| Molecular Formula: | C22 H20 N6 O S2 |
| Smiles: | Cc1ccc(cc1C)c1cc2c3nnc(n3ccn2n1)SCC(NCc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7394 |
| logD: | 3.2078 |
| logSw: | -3.8525 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.798 |
| InChI Key: | OAUGGZHEOARENV-UHFFFAOYSA-N |