ethyl 2-{[(6-hydroxy-7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate
Chemical Structure Depiction of
ethyl 2-{[(6-hydroxy-7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate
ethyl 2-{[(6-hydroxy-7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate
Compound characteristics
| Compound ID: | Y041-2641 |
| Compound Name: | ethyl 2-{[(6-hydroxy-7-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl]amino}benzoate |
| Molecular Weight: | 353.37 |
| Molecular Formula: | C20 H19 N O5 |
| Smiles: | CCOC(c1ccccc1NCC1=CC(=O)Oc2cc(C)c(cc12)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7205 |
| logD: | 3.7194 |
| logSw: | -3.5283 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.484 |
| InChI Key: | PEVDOHMVTXLZDJ-UHFFFAOYSA-N |