3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}propanamide
Chemical Structure Depiction of
3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}propanamide
3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | F656-0417 |
| Compound Name: | 3-[7-(5-chloro-2-methylphenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-{[4-(dimethylamino)phenyl]methyl}propanamide |
| Molecular Weight: | 492.02 |
| Molecular Formula: | C27 H30 Cl N5 O2 |
| Smiles: | Cc1ccc(cc1n1c(C)c(C)c2C(N(CCC(NCc3ccc(cc3)N(C)C)=O)C=Nc12)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2759 |
| logD: | 4.2605 |
| logSw: | -4.7337 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.619 |
| InChI Key: | QKVTYWXZAFTMSZ-UHFFFAOYSA-N |