N-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
N-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-1078 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 437.47 |
| Molecular Formula: | C24 H24 F N3 O4 |
| Smiles: | COc1ccc(c(c1)OC)NC(C1CCC2=C(CC1)N=C(c1ccc(cc1)F)NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1149 |
| logD: | 2.0335 |
| logSw: | -3.3949 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.76 |
| InChI Key: | GQYYMEGSWOOFIE-OAHLLOKOSA-N |