2-(4-fluorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
2-(4-fluorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
2-(4-fluorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-0874 |
| Compound Name: | 2-(4-fluorophenyl)-N-methyl-N-(1-methylpiperidin-4-yl)-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C23 H29 F N4 O2 |
| Smiles: | CN1CCC(CC1)N(C)C(C1CCC2=C(CC1)N=C(c1ccc(cc1)F)NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7822 |
| logD: | 1.7822 |
| logSw: | -2.3267 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.872 |
| InChI Key: | TZRYXKOGNUACIG-MRXNPFEDSA-N |