N-[(1,3-dimethyl-1H-pyrazol-5-yl)methyl]-4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-[(1,3-dimethyl-1H-pyrazol-5-yl)methyl]-4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
N-[(1,3-dimethyl-1H-pyrazol-5-yl)methyl]-4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | SD54-0494 |
| Compound Name: | N-[(1,3-dimethyl-1H-pyrazol-5-yl)methyl]-4-ethoxy-2-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine-7-carboxamide |
| Molecular Weight: | 419.53 |
| Molecular Formula: | C24 H29 N5 O2 |
| Smiles: | CCOc1c2CCC(CCc2nc(c2ccccc2)n1)C(NCc1cc(C)nn1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.685 |
| logD: | 3.685 |
| logSw: | -3.8824 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.388 |
| InChI Key: | KJKGXZXUMNHVEW-SFHVURJKSA-N |