3-{[3-(2H-1,3-benzodioxol-5-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}quinolin-2(1H)-one
Chemical Structure Depiction of
3-{[3-(2H-1,3-benzodioxol-5-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}quinolin-2(1H)-one
3-{[3-(2H-1,3-benzodioxol-5-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}quinolin-2(1H)-one
Compound characteristics
| Compound ID: | 4004-0197 |
| Compound Name: | 3-{[3-(2H-1,3-benzodioxol-5-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl}quinolin-2(1H)-one |
| Molecular Weight: | 391.4 |
| Molecular Formula: | C20 H13 N3 O4 S |
| Smiles: | C1Oc2ccc(cc2O1)N1C(=N)SC(=C/C2=Cc3ccccc3NC2=O)\C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.9403 |
| logD: | 2.9385 |
| logSw: | -3.4318 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.362 |
| InChI Key: | PCLQQAGFVCOORF-UHFFFAOYSA-N |