ethyl 1-{[(2-nitrothiophen-3-yl)sulfanyl]acetyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{[(2-nitrothiophen-3-yl)sulfanyl]acetyl}piperidine-3-carboxylate
ethyl 1-{[(2-nitrothiophen-3-yl)sulfanyl]acetyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | C755-0270 |
| Compound Name: | ethyl 1-{[(2-nitrothiophen-3-yl)sulfanyl]acetyl}piperidine-3-carboxylate |
| Molecular Weight: | 358.43 |
| Molecular Formula: | C14 H18 N2 O5 S2 |
| Smiles: | CCOC(C1CCCN(C1)C(CSc1ccsc1[N+]([O-])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0809 |
| logD: | 2.0809 |
| logSw: | -2.3718 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.497 |
| InChI Key: | AGBJHLAQEOHRMC-JTQLQIEISA-N |