N-[(4-methoxyphenyl)methyl]-2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
N-[(4-methoxyphenyl)methyl]-2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
Compound characteristics
| Compound ID: | SD50-0470 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-2-(4-methylphenyl)-3-oxo-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C24 H27 N3 O3 |
| Smiles: | Cc1ccc(cc1)N1C(C2CCC(CCC=2N1)C(NCc1ccc(cc1)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2121 |
| logD: | 2.7902 |
| logSw: | -3.2385 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.497 |
| InChI Key: | AVDZBINEBSSYJA-GOSISDBHSA-N |