2-(4-methylphenyl)-3-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
Chemical Structure Depiction of
2-(4-methylphenyl)-3-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
2-(4-methylphenyl)-3-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
Compound characteristics
| Compound ID: | SD50-0460 |
| Compound Name: | 2-(4-methylphenyl)-3-oxo-N-[(pyridin-3-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide |
| Molecular Weight: | 376.46 |
| Molecular Formula: | C22 H24 N4 O2 |
| Smiles: | Cc1ccc(cc1)N1C(C2CCC(CCC=2N1)C(NCc1cccnc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.002 |
| logD: | 1.5801 |
| logSw: | -1.659 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.471 |
| InChI Key: | IXLJCUIITFMYIF-KRWDZBQOSA-N |