2-oxo-4-propyl-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
2-oxo-4-propyl-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
2-oxo-4-propyl-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | Y040-0562 |
| Compound Name: | 2-oxo-4-propyl-2H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 398.41 |
| Molecular Formula: | C22 H22 O7 |
| Smiles: | CCCC1=CC(=O)Oc2cc(ccc12)OC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4189 |
| logD: | 3.4189 |
| logSw: | -3.7463 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.001 |
| InChI Key: | NOYSTBOLKNCDTQ-UHFFFAOYSA-N |