ethyl 2-{[1-(thiophene-2-sulfonyl)piperidine-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[1-(thiophene-2-sulfonyl)piperidine-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{[1-(thiophene-2-sulfonyl)piperidine-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
Compound ID: | D356-2468 |
Compound Name: | ethyl 2-{[1-(thiophene-2-sulfonyl)piperidine-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
Molecular Weight: | 482.64 |
Molecular Formula: | C21 H26 N2 O5 S3 |
Smiles: | CCOC(c1c2CCCCc2sc1NC(C1CCCN(C1)S(c1cccs1)(=O)=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.495 |
logD: | 0.1044 |
logSw: | -3.7818 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.461 |
InChI Key: | VVCAPVQLIBKCTC-AWEZNQCLSA-N |