7-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-2-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[d]pyrimidin-4-one
Chemical Structure Depiction of
7-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-2-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[d]pyrimidin-4-one
7-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-2-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[d]pyrimidin-4-one
Compound characteristics
| Compound ID: | SB25-0436 |
| Compound Name: | 7-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-2-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[d]pyrimidin-4-one |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C25 H26 N4 O4 |
| Smiles: | C1CC2=C(CCC1C(N1CCN(CC1)C(c1ccco1)=O)=O)N=C(c1ccccc1)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7471 |
| logD: | 1.3908 |
| logSw: | -2.1257 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.876 |
| InChI Key: | BPHIFCHYGUIACF-GOSISDBHSA-N |