1,5-dimethyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1,5-dimethyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrazole-3-carboxamide
1,5-dimethyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | SC87-0563 |
| Compound Name: | 1,5-dimethyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C22 H25 N5 O2 |
| Smiles: | Cc1cc(C(NCC2CCC3=C(CC2)N=C(c2ccccc2)NC3=O)=O)nn1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8366 |
| logD: | 1.4802 |
| logSw: | -2.3855 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.093 |
| InChI Key: | HEWGPIIALVYENW-OAHLLOKOSA-N |