methyl 2-[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate
Chemical Structure Depiction of
methyl 2-[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate
methyl 2-[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate
Compound characteristics
| Compound ID: | Y040-7268 |
| Compound Name: | methyl 2-[(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]propanoate |
| Molecular Weight: | 408.49 |
| Molecular Formula: | C25 H28 O5 |
| Smiles: | CCCCCCc1cc2C(=CC(=O)Oc2cc1OC(C)C(=O)OC)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2326 |
| logD: | 6.2326 |
| logSw: | -5.4347 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.424 |
| InChI Key: | FADSVKHSIPGTHJ-KRWDZBQOSA-N |