2-[7-(4-chlorophenyl)-5,6-dimethyl-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-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-({4-[(propan-2-yl)oxy]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-[(propan-2-yl)oxy]phenyl}methyl)acetamide
Compound characteristics
| Compound ID: | F509-0492 |
| Compound Name: | 2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-({4-[(propan-2-yl)oxy]phenyl}methyl)acetamide |
| Molecular Weight: | 478.98 |
| Molecular Formula: | C26 H27 Cl N4 O3 |
| Smiles: | [H]C1=Nc2c(C(N1CC(NCc1ccc(cc1)OC(C)C)=O)=O)c(C)c(C)n2c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2179 |
| logD: | 4.2179 |
| logSw: | -4.8122 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.939 |
| InChI Key: | BTZAUHCSBHFCGY-UHFFFAOYSA-N |