N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-3-(1H-indol-3-yl)propanamide
Chemical Structure Depiction of
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-3-(1H-indol-3-yl)propanamide
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-3-(1H-indol-3-yl)propanamide
Compound characteristics
| Compound ID: | SC87-0633 |
| Compound Name: | N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}-3-(1H-indol-3-yl)propanamide |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C27 H27 F N4 O2 |
| Smiles: | C1CC2=C(CCC1CNC(CCc1c[nH]c3ccccc13)=O)N=C(c1ccc(cc1)F)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6226 |
| logD: | 2.5412 |
| logSw: | -4.019 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.264 |
| InChI Key: | JOHSQKQCLDLRIS-QGZVFWFLSA-N |