4-oxo-2-phenyl-N-(pyridin-4-yl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
4-oxo-2-phenyl-N-(pyridin-4-yl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
4-oxo-2-phenyl-N-(pyridin-4-yl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-0441 |
| Compound Name: | 4-oxo-2-phenyl-N-(pyridin-4-yl)-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C21 H20 N4 O2 |
| Smiles: | C1CC2=C(CCC1C(Nc1ccncc1)=O)N=C(c1ccccc1)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7579 |
| logD: | 1.4015 |
| logSw: | -1.8324 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.712 |
| InChI Key: | WTHSQMVEIHNKHQ-OAHLLOKOSA-N |