ethyl 1-(2-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethyl)piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(2-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethyl)piperidine-3-carboxylate
ethyl 1-(2-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethyl)piperidine-3-carboxylate
Compound characteristics
| Compound ID: | 8016-5379 |
| Compound Name: | ethyl 1-(2-{[3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-2-oxoethyl)piperidine-3-carboxylate |
| Molecular Weight: | 422.54 |
| Molecular Formula: | C21 H30 N2 O5 S |
| Smiles: | CCOC(C1CCCN(C1)CC(Nc1c(C(=O)OCC)c2CCCCc2s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6911 |
| logD: | 0.609 |
| logSw: | -4.0193 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.276 |
| InChI Key: | NTMHOZMLZDOMDI-AWEZNQCLSA-N |