ethyl 3-[(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)carbamamido]benzoate
Chemical Structure Depiction of
ethyl 3-[(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)carbamamido]benzoate
ethyl 3-[(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)carbamamido]benzoate
Compound characteristics
| Compound ID: | E679-0476 |
| Compound Name: | ethyl 3-[(2-methyl-1-oxo-1,2-dihydroisoquinolin-4-yl)carbamamido]benzoate |
| Molecular Weight: | 365.39 |
| Molecular Formula: | C20 H19 N3 O4 |
| Smiles: | CCOC(c1cccc(c1)NC(NC1=CN(C)C(c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1785 |
| logD: | 3.1313 |
| logSw: | -3.5187 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.207 |
| InChI Key: | HUKPBYWYGIFQTL-UHFFFAOYSA-N |