methyl 4-{5-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
methyl 4-{5-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]furan-2-yl}benzoate
methyl 4-{5-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 4285-0539 |
| Compound Name: | methyl 4-{5-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 358.35 |
| Molecular Formula: | C22 H14 O5 |
| Smiles: | COC(c1ccc(cc1)c1ccc(C=C2C(c3ccccc3C2=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7095 |
| logD: | 4.7095 |
| logSw: | -4.6862 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.29 |
| InChI Key: | NLFWFWIYCFFDBN-UHFFFAOYSA-N |