[(2-oxo-2-{[3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}ethyl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(2-oxo-2-{[3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}ethyl)sulfanyl]acetic acid
[(2-oxo-2-{[3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}ethyl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | Y205-5430 |
| Compound Name: | [(2-oxo-2-{[3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}ethyl)sulfanyl]acetic acid |
| Molecular Weight: | 396.53 |
| Molecular Formula: | C18 H24 N2 O4 S2 |
| Smiles: | C1CCN(CC1)C(c1c2CCCCc2sc1NC(CSCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4349 |
| logD: | -0.9336 |
| logSw: | -2.4899 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.135 |
| InChI Key: | CATCSIYLTYKECN-UHFFFAOYSA-N |