2-[(3-methylphenoxy)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
2-[(3-methylphenoxy)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
2-[(3-methylphenoxy)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC89-0115 |
| Compound Name: | 2-[(3-methylphenoxy)acetyl]-8-[(pyrrolidin-1-yl)methyl]-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C20 H28 N2 O4 S |
| Smiles: | Cc1cccc(c1)OCC(N1CC2(C1)C(CCS2(=O)=O)CN1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4847 |
| logD: | -0.1889 |
| logSw: | -2.3152 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.967 |
| InChI Key: | SVNBTOLHKHXZTM-KRWDZBQOSA-N |