3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | 4300-0911 |
| Compound Name: | 3-(4-tert-butylphenoxy)-4-oxo-4H-1-benzopyran-7-yl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 504.54 |
| Molecular Formula: | C29 H28 O8 |
| Smiles: | CC(C)(C)c1ccc(cc1)OC1=COc2cc(ccc2C1=O)OC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4444 |
| logD: | 5.4444 |
| logSw: | -5.6035 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.926 |
| InChI Key: | AIKJZKZFFOJASY-UHFFFAOYSA-N |