N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-2-(pyridin-3-yl)acetamide
Chemical Structure Depiction of
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-2-(pyridin-3-yl)acetamide
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-2-(pyridin-3-yl)acetamide
Compound characteristics
| Compound ID: | SC87-0594 |
| Compound Name: | N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-2-(pyridin-3-yl)acetamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C23 H23 F N4 O2 |
| Smiles: | C1CC2=C(CCC1CNC(Cc1cccnc1)=O)N=C(c1ccc(cc1)F)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7567 |
| logD: | 0.6753 |
| logSw: | -1.6041 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.911 |
| InChI Key: | ZKKWCBFSZGDUMK-OAHLLOKOSA-N |