3-{5-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]furan-2-yl}benzoic acid
Chemical Structure Depiction of
3-{5-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]furan-2-yl}benzoic acid
3-{5-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]furan-2-yl}benzoic acid
Compound characteristics
| Compound ID: | 5792-6742 |
| Compound Name: | 3-{5-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]furan-2-yl}benzoic acid |
| Molecular Weight: | 356.4 |
| Molecular Formula: | C18 H16 N2 O4 S |
| Smiles: | CCCN1C(/C(=C/c2ccc(c3cccc(c3)C(O)=O)o2)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0191 |
| logD: | 0.5065 |
| logSw: | -3.9821 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.736 |
| InChI Key: | KXFYOCKIQJYZMF-UHFFFAOYSA-N |