ethyl 4-[2-(3-ethyl-4-oxo-7-phenyl-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 4-[2-(3-ethyl-4-oxo-7-phenyl-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl)acetamido]benzoate
ethyl 4-[2-(3-ethyl-4-oxo-7-phenyl-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl)acetamido]benzoate
Compound characteristics
Compound ID: | L935-0136 |
Compound Name: | ethyl 4-[2-(3-ethyl-4-oxo-7-phenyl-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl)acetamido]benzoate |
Molecular Weight: | 444.49 |
Molecular Formula: | C25 H24 N4 O4 |
Smiles: | CCN1C=Nc2c(cn(CC(Nc3ccc(cc3)C(=O)OCC)=O)c2C1=O)c1ccccc1 |
Stereo: | ACHIRAL |
logP: | 3.7051 |
logD: | 3.705 |
logSw: | -3.8042 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.585 |
InChI Key: | ASVVTJCIMCNLTK-UHFFFAOYSA-N |