2-(3-chlorophenyl)-N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}acetamide
Chemical Structure Depiction of
2-(3-chlorophenyl)-N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}acetamide
2-(3-chlorophenyl)-N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}acetamide
Compound characteristics
| Compound ID: | SC87-0599 |
| Compound Name: | 2-(3-chlorophenyl)-N-{[2-(4-fluorophenyl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl]methyl}acetamide |
| Molecular Weight: | 439.92 |
| Molecular Formula: | C24 H23 Cl F N3 O2 |
| Smiles: | C1CC2=C(CCC1CNC(Cc1cccc(c1)[Cl])=O)N=C(c1ccc(cc1)F)NC2=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7451 |
| logD: | 2.6637 |
| logSw: | -4.3478 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.393 |
| InChI Key: | GNRKJCXMGRRILZ-HNNXBMFYSA-N |