4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl 3,4,5-trimethoxybenzoate
Chemical Structure Depiction of
4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl 3,4,5-trimethoxybenzoate
4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl 3,4,5-trimethoxybenzoate
Compound characteristics
| Compound ID: | Y040-3742 |
| Compound Name: | 4,7-dimethyl-2-oxo-2H-1-benzopyran-5-yl 3,4,5-trimethoxybenzoate |
| Molecular Weight: | 384.38 |
| Molecular Formula: | C21 H20 O7 |
| Smiles: | CC1=CC(=O)Oc2cc(C)cc(c12)OC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2562 |
| logD: | 3.2562 |
| logSw: | -3.4743 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.088 |
| InChI Key: | UOPIPGSHTSLEDF-UHFFFAOYSA-N |