2-phenyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3(2H)-one
Chemical Structure Depiction of
2-phenyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3(2H)-one
2-phenyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3(2H)-one
Compound characteristics
| Compound ID: | SD50-0005 |
| Compound Name: | 2-phenyl-6-[4-(pyridin-2-yl)piperazine-1-carbonyl]-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-3(2H)-one |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C24 H27 N5 O2 |
| Smiles: | C1CC2=C(CCC1C(N1CCN(CC1)c1ccccn1)=O)NN(C2=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9008 |
| logD: | 2.5385 |
| logSw: | -3.1025 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.96 |
| InChI Key: | FIMXNCVMNAKKPL-GOSISDBHSA-N |