ethyl 2-{2-[4-oxo-7-phenyl-3-(propan-2-yl)-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]acetamido}benzoate
Chemical Structure Depiction of
ethyl 2-{2-[4-oxo-7-phenyl-3-(propan-2-yl)-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]acetamido}benzoate
ethyl 2-{2-[4-oxo-7-phenyl-3-(propan-2-yl)-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L935-0868 |
| Compound Name: | ethyl 2-{2-[4-oxo-7-phenyl-3-(propan-2-yl)-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl]acetamido}benzoate |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C26 H26 N4 O4 |
| Smiles: | CCOC(c1ccccc1NC(Cn1cc(c2ccccc2)c2c1C(N(C=N2)C(C)C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6708 |
| logD: | 3.6495 |
| logSw: | -3.733 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.048 |
| InChI Key: | KYXLIFSXPGNGOQ-UHFFFAOYSA-N |