3-oxo-2-phenyl-N-[(thiophen-2-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
Chemical Structure Depiction of
3-oxo-2-phenyl-N-[(thiophen-2-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
3-oxo-2-phenyl-N-[(thiophen-2-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide
Compound characteristics
| Compound ID: | SD50-0055 |
| Compound Name: | 3-oxo-2-phenyl-N-[(thiophen-2-yl)methyl]-1,2,3,4,5,6,7,8-octahydrocyclohepta[c]pyrazole-6-carboxamide |
| Molecular Weight: | 367.47 |
| Molecular Formula: | C20 H21 N3 O2 S |
| Smiles: | C1CC2=C(CCC1C(NCc1cccs1)=O)NN(C2=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6598 |
| logD: | 2.2975 |
| logSw: | -2.9039 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.971 |
| InChI Key: | SHVBDSAXGTUGGR-AWEZNQCLSA-N |