4-ethoxy-N-(oxan-4-yl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-ethoxy-N-(oxan-4-yl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
4-ethoxy-N-(oxan-4-yl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0471 |
| Compound Name: | 4-ethoxy-N-(oxan-4-yl)-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C23 H29 N3 O3 |
| Smiles: | CCOc1c2CCC(CCc2nc(c2ccccc2)n1)C(NC1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1874 |
| logD: | 4.1874 |
| logSw: | -4.0948 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.219 |
| InChI Key: | FHBPJAOZCUWXDA-KRWDZBQOSA-N |