2-[5,6-dimethyl-7-(4-methylphenyl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
Chemical Structure Depiction of
2-[5,6-dimethyl-7-(4-methylphenyl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
2-[5,6-dimethyl-7-(4-methylphenyl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide
Compound characteristics
| Compound ID: | F509-0339 |
| Compound Name: | 2-[5,6-dimethyl-7-(4-methylphenyl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | CC(C)Oc1ccc(CNC(CN2C=Nc3c(C2=O)c(C)c(C)n3c2ccc(C)cc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0466 |
| logD: | 4.0466 |
| logSw: | -4.2051 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.939 |
| InChI Key: | XLAAWBQLCMRCRN-UHFFFAOYSA-N |