methyl 1-[2-methyl-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
methyl 1-[2-methyl-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
methyl 1-[2-methyl-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | D470-0046 |
| Compound Name: | methyl 1-[2-methyl-5-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]piperidine-4-carboxylate |
| Molecular Weight: | 430.5 |
| Molecular Formula: | C17 H22 N2 O7 S2 |
| Smiles: | Cc1ccc(cc1S(N1CCC(CC1)C(=O)OC)(=O)=O)N1C(CCS1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5271 |
| logD: | 0.5271 |
| logSw: | -2.1591 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 98.54 |
| InChI Key: | XKJBBMZURZCFLU-UHFFFAOYSA-N |