N-(3-fluoro-4-methylphenyl)-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
N-(3-fluoro-4-methylphenyl)-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-0968 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C23 H22 F N3 O2 |
| Smiles: | Cc1ccc(cc1F)NC(C1CCC2=C(CC1)N=C(c1ccccc1)NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5867 |
| logD: | 3.2304 |
| logSw: | -3.7536 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.284 |
| InChI Key: | GLKLPEHBHPGVFD-INIZCTEOSA-N |