2-(4-fluorophenyl)-N-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
2-(4-fluorophenyl)-N-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
2-(4-fluorophenyl)-N-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-0917 |
| Compound Name: | 2-(4-fluorophenyl)-N-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C23 H23 F N4 O2 |
| Smiles: | CN(Cc1cccnc1)C(C1CCC2=C(CC1)N=C(c1ccc(cc1)F)NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2167 |
| logD: | 1.1353 |
| logSw: | -2.3156 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.861 |
| InChI Key: | QZINPHJHOYTIGH-QGZVFWFLSA-N |