4-ethoxy-2-phenyl-N-[(pyridin-4-yl)methyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-ethoxy-2-phenyl-N-[(pyridin-4-yl)methyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
4-ethoxy-2-phenyl-N-[(pyridin-4-yl)methyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0470 |
| Compound Name: | 4-ethoxy-2-phenyl-N-[(pyridin-4-yl)methyl]-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 402.5 |
| Molecular Formula: | C24 H26 N4 O2 |
| Smiles: | CCOc1c2CCC(CCc2nc(c2ccccc2)n1)C(NCc1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8192 |
| logD: | 3.8158 |
| logSw: | -3.7561 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.013 |
| InChI Key: | HHSNWRFQPPJBDQ-IBGZPJMESA-N |