N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}pyridine-4-carboxamide
Chemical Structure Depiction of
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}pyridine-4-carboxamide
N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}pyridine-4-carboxamide
Compound characteristics
| Compound ID: | SC87-0668 |
| Compound Name: | N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}pyridine-4-carboxamide |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C22 H21 F N4 O2 |
| Smiles: | C1CC2=C(CCC1CNC(c1ccncc1)=O)N=C(c1ccc(cc1)F)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0048 |
| logD: | 0.9234 |
| logSw: | -1.9954 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.034 |
| InChI Key: | XQMZRGPJRNPRLC-CQSZACIVSA-N |