2-(5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)-1H-isoindole-1,3(2H)-dione
2-(5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3448-5429 |
| Compound Name: | 2-(5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 263.29 |
| Molecular Formula: | C10 H5 N3 O2 S2 |
| Smiles: | c1ccc2C(N(C3=NNC(=S)S3)C(c2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9393 |
| logD: | -5.9684 |
| logSw: | -2.5886 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.792 |
| InChI Key: | POHQXTLOKNHKCJ-UHFFFAOYSA-N |