methyl 4-{5-[(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
methyl 4-{5-[(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
methyl 4-{5-[(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 4299-0744 |
| Compound Name: | methyl 4-{5-[(3-methyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 343.36 |
| Molecular Formula: | C17 H13 N O5 S |
| Smiles: | CN1C(/C(=C/c2ccc(c3ccc(cc3)C(=O)OC)o2)SC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8381 |
| logD: | 3.8381 |
| logSw: | -4.1296 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.376 |
| InChI Key: | KBCHJSRUDKQYNB-UHFFFAOYSA-N |