Tetramethylscutellarein
Representations & DB's id
| ||
| ChEBI: | CHEBI:34357 | |
|---|---|---|
| ChEMBL: | CHEMBL75349 | |
| PubChem: | 96118 | |
| IUPAC: | 5,6,7-trimethoxy-2-(4-methoxyphenyl)chromen-4-one | |
| Standard InChI: | InChI=1S/C19H18O6/c1-21-12-7-5-11(6-8-12)14-9-13(20)17-15(25-14)10-16(22-2)18(23-3)19(17)24-4/h5-10H,1-4H3 | |
| Standard InChI Key: | URSUMOWUGDXZHU-UHFFFAOYSA-N | |
| SMILES: | COc1ccc(cc1)c1cc(=O)c2c(o1)cc(c(c2OC)OC)OC | |
Molecular propeties
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| AlogP: | 3.49 | |
|---|---|---|
| Hydrogen bonds acceptors: | 6 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 5 | |
| Number of rings: | 3 | |
| Molecular Weight: | 342.11 | |
| Topological polar surface area: | 63.2 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.211 | |
| Number of carbons: | 19 | |