{[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetonitrile
Chemical Structure Depiction of
{[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetonitrile
{[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetonitrile
Compound characteristics
| Compound ID: | 8020-1156 |
| Compound Name: | {[3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl]oxy}acetonitrile |
| Molecular Weight: | 323.3 |
| Molecular Formula: | C18 H13 N O5 |
| Smiles: | COc1ccc(cc1)OC1=COc2cc(ccc2C1=O)OCC#N |
| Stereo: | ACHIRAL |
| logP: | 2.522 |
| logD: | 2.522 |
| logSw: | -2.9936 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.023 |
| InChI Key: | NTKVQLGDIZWMNC-UHFFFAOYSA-N |