3-(4-methoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]propanamide
Chemical Structure Depiction of
3-(4-methoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]propanamide
3-(4-methoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]propanamide
Compound characteristics
| Compound ID: | SC87-0532 |
| Compound Name: | 3-(4-methoxyphenyl)-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]propanamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C26 H29 N3 O3 |
| Smiles: | COc1ccc(CCC(NCC2CCC3=C(CC2)N=C(c2ccccc2)NC3=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4174 |
| logD: | 3.0611 |
| logSw: | -3.6705 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.937 |
| InChI Key: | KKXSMKUNLXGPBX-LJQANCHMSA-N |