1-methyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
1-methyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrrole-2-carboxamide
1-methyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | SC87-1096 |
| Compound Name: | 1-methyl-N-[(4-oxo-2-phenyl-4,5,6,7,8,9-hexahydro-3H-cyclohepta[d]pyrimidin-7-yl)methyl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 376.46 |
| Molecular Formula: | C22 H24 N4 O2 |
| Smiles: | Cn1cccc1C(NCC1CCC2=C(CC1)N=C(c1ccccc1)NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1345 |
| logD: | 2.7781 |
| logSw: | -3.4091 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.023 |
| InChI Key: | IXPDVYCBZULXTK-OAHLLOKOSA-N |