1-[4-(4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carbonyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carbonyl)piperazin-1-yl]ethan-1-one
1-[4-(4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carbonyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | SD54-0528 |
| Compound Name: | 1-[4-(4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carbonyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 422.53 |
| Molecular Formula: | C24 H30 N4 O3 |
| Smiles: | CCOc1c2CCC(CCc2nc(c2ccccc2)n1)C(N1CCN(CC1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7311 |
| logD: | 3.7311 |
| logSw: | -3.9179 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.016 |
| InChI Key: | CCUSYROTCPXCLP-IBGZPJMESA-N |