N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-0087 |
| Compound Name: | N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 422.57 |
| Molecular Formula: | C25 H34 N4 O2 |
| Smiles: | CC1NC(C2CCC(CCC=2N=1)C(NCCN1CCC(CC1)Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6371 |
| logD: | 1.3762 |
| logSw: | -2.9669 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.102 |
| InChI Key: | BRUQOQOQYJJFBS-OAQYLSRUSA-N |