ethyl 4-[(5,7-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(5,7-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate
ethyl 4-[(5,7-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D103-0551 |
| Compound Name: | ethyl 4-[(5,7-dimethyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate |
| Molecular Weight: | 365.38 |
| Molecular Formula: | C21 H19 N O5 |
| Smiles: | [H]N(C(C1=CC(c2c(C)cc(C)cc2O1)=O)=O)c1ccc(cc1)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.9641 |
| logD: | 4.9571 |
| logSw: | -4.7269 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.902 |
| InChI Key: | LZYMLRJYXCVICV-UHFFFAOYSA-N |