N,N-dimethyl-2-{4-[2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carbonyl]piperazin-1-yl}acetamide
Chemical Structure Depiction of
N,N-dimethyl-2-{4-[2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carbonyl]piperazin-1-yl}acetamide
N,N-dimethyl-2-{4-[2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carbonyl]piperazin-1-yl}acetamide
Compound characteristics
| Compound ID: | SD50-0532 |
| Compound Name: | N,N-dimethyl-2-{4-[2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carbonyl]piperazin-1-yl}acetamide |
| Molecular Weight: | 439.56 |
| Molecular Formula: | C24 H33 N5 O3 |
| Smiles: | Cc1ccc(cc1)N1C(C2CCC(CCC=2N1)C(N1CCN(CC1)CC(N(C)C)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8598 |
| logD: | 0.4379 |
| logSw: | -1.9598 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.473 |
| InChI Key: | HDKKTVWINTXLPL-GOSISDBHSA-N |