N-[(2,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
N-[(2,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SB25-1208 |
| Compound Name: | N-[(2,5-dimethylphenyl)methyl]-2-methyl-4-oxo-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 339.44 |
| Molecular Formula: | C20 H25 N3 O2 |
| Smiles: | CC1NC(C2CCC(CCC=2N=1)C(NCc1cc(C)ccc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5021 |
| logD: | 2.5002 |
| logSw: | -2.7075 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.55 |
| InChI Key: | USHUEYLVEKASTF-OAHLLOKOSA-N |