ethyl 1-{2-[(5,6-dihydro-1,4-oxathiine-2-carbonyl)amino]benzoyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[(5,6-dihydro-1,4-oxathiine-2-carbonyl)amino]benzoyl}piperidine-4-carboxylate
ethyl 1-{2-[(5,6-dihydro-1,4-oxathiine-2-carbonyl)amino]benzoyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | G370-0689 |
| Compound Name: | ethyl 1-{2-[(5,6-dihydro-1,4-oxathiine-2-carbonyl)amino]benzoyl}piperidine-4-carboxylate |
| Molecular Weight: | 404.48 |
| Molecular Formula: | C20 H24 N2 O5 S |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccccc1NC(C1=CSCCO1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9745 |
| logD: | 1.4434 |
| logSw: | -2.7801 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.663 |
| InChI Key: | HOQLQEMEZHMLBX-UHFFFAOYSA-N |