methyl 2-{[(7-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[(7-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate
methyl 2-{[(7-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate
Compound characteristics
| Compound ID: | Y041-2633 |
| Compound Name: | methyl 2-{[(7-methoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C19 H17 N O5 |
| Smiles: | COC(c1ccccc1NCC1=CC(=O)Oc2cc(ccc12)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2761 |
| logD: | 3.2761 |
| logSw: | -3.7641 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.9 |
| InChI Key: | DWENLMUFTKMYIJ-UHFFFAOYSA-N |