3-(2H-1,3-benzodioxol-5-yl)-5-benzylidene-2-imino-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-benzylidene-2-imino-1,3-thiazolidin-4-one
3-(2H-1,3-benzodioxol-5-yl)-5-benzylidene-2-imino-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3601-0361 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-benzylidene-2-imino-1,3-thiazolidin-4-one |
| Molecular Weight: | 324.36 |
| Molecular Formula: | C17 H12 N2 O3 S |
| Smiles: | C1Oc2ccc(cc2O1)N1C(=N)SC(=C/c2ccccc2)\C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.2496 |
| logD: | 3.2496 |
| logSw: | -3.4423 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.484 |
| InChI Key: | VPQIPELBZKHOFX-UHFFFAOYSA-N |