8-(2H-1,3-benzodioxole-5-carbonyl)-4-benzyl-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione
Chemical Structure Depiction of
8-(2H-1,3-benzodioxole-5-carbonyl)-4-benzyl-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione
8-(2H-1,3-benzodioxole-5-carbonyl)-4-benzyl-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione
Compound characteristics
| Compound ID: | T140-1055 |
| Compound Name: | 8-(2H-1,3-benzodioxole-5-carbonyl)-4-benzyl-1lambda~6~-thia-4,8-diazaspiro[4.5]decane-1,1,3-trione |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C22 H22 N2 O6 S |
| Smiles: | C1CN(CCC12N(Cc1ccccc1)C(CS2(=O)=O)=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6645 |
| logD: | 1.5989 |
| logSw: | -2.4244 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.794 |
| InChI Key: | RRWNUFNIVWQUFM-UHFFFAOYSA-N |