2-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-7-methyl-4H-1-benzopyran-4-one
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-7-methyl-4H-1-benzopyran-4-one
2-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-7-methyl-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 8018-5312 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-3-hydroxy-7-methyl-4H-1-benzopyran-4-one |
| Molecular Weight: | 296.28 |
| Molecular Formula: | C17 H12 O5 |
| Smiles: | Cc1ccc2C(C(=C(c3ccc4c(c3)OCO4)Oc2c1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2802 |
| logD: | 3.2651 |
| logSw: | -3.2443 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.464 |
| InChI Key: | NLBFOUFEUOEBMX-UHFFFAOYSA-N |