4-benzamidothiolan-3-yl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate
Chemical Structure Depiction of
4-benzamidothiolan-3-yl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate
4-benzamidothiolan-3-yl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate
Compound characteristics
| Compound ID: | 8013-1058 |
| Compound Name: | 4-benzamidothiolan-3-yl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate |
| Molecular Weight: | 424.47 |
| Molecular Formula: | C22 H20 N2 O5 S |
| Smiles: | C(CN1C(c2ccccc2C1=O)=O)C(=O)OC1CSCC1NC(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2424 |
| logD: | 2.2424 |
| logSw: | -2.9664 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.876 |
| InChI Key: | BZSLCHGJWXNMDJ-UHFFFAOYSA-N |