2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate
Chemical Structure Depiction of
2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate
2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate
Compound characteristics
| Compound ID: | Y041-4468 |
| Compound Name: | 2-[(2-methyl-2H-1-benzopyran-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate |
| Molecular Weight: | 424.45 |
| Molecular Formula: | C27 H20 O5 |
| Smiles: | CC1C(=Cc2ccccc2O1)/C=C1/C(c2ccc(cc2O1)OC(c1ccccc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9432 |
| logD: | 5.9432 |
| logSw: | -5.6603 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.392 |
| InChI Key: | LWZJIAVLEMDFEL-KRWDZBQOSA-N |