2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}acetamide
Chemical Structure Depiction of
2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}acetamide
2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}acetamide
Compound characteristics
| Compound ID: | F509-0485 |
| Compound Name: | 2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}acetamide |
| Molecular Weight: | 463.97 |
| Molecular Formula: | C25 H26 Cl N5 O2 |
| Smiles: | [H]C1=Nc2c(C(N1CC(NCc1ccc(cc1)N(C)C)=O)=O)c(C)c(C)n2c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6414 |
| logD: | 3.626 |
| logSw: | -4.5904 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.941 |
| InChI Key: | OZKLUZUCCYLJEP-UHFFFAOYSA-N |