methyl 4-[(6-methyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(6-methyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate
methyl 4-[(6-methyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | D103-0060 |
| Compound Name: | methyl 4-[(6-methyl-4-oxo-4H-1-benzopyran-2-carbonyl)amino]benzoate |
| Molecular Weight: | 337.33 |
| Molecular Formula: | C19 H15 N O5 |
| Smiles: | [H]N(C(C1=CC(c2cc(C)ccc2O1)=O)=O)c1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.6756 |
| logD: | 3.6686 |
| logSw: | -3.9932 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.322 |
| InChI Key: | XBOYJUKYKURQLA-UHFFFAOYSA-N |