2-(4-ethoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]acetamide
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]acetamide
2-(4-ethoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]acetamide
Compound characteristics
| Compound ID: | SC87-1099 |
| Compound Name: | 2-(4-ethoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]acetamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C26 H29 N3 O3 |
| Smiles: | CCOc1ccc(CC(NCC2CCC3=C(CC2)N=C(c2ccccc2)NC3=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2789 |
| logD: | 2.9226 |
| logSw: | -3.4848 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.516 |
| InChI Key: | ZNICBQBPSGJKOC-LJQANCHMSA-N |