4-oxo-4-{[6-phenyl-3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}butanoic acid
Chemical Structure Depiction of
4-oxo-4-{[6-phenyl-3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}butanoic acid
4-oxo-4-{[6-phenyl-3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}butanoic acid
Compound characteristics
| Compound ID: | Y200-5910 |
| Compound Name: | 4-oxo-4-{[6-phenyl-3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}butanoic acid |
| Molecular Weight: | 415.51 |
| Molecular Formula: | C22 H25 N O5 S |
| Smiles: | CCCOC(c1c2CCC(Cc2sc1NC(CCC(O)=O)=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9988 |
| logD: | 1.0494 |
| logSw: | -4.1525 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.263 |
| InChI Key: | ONMJSURKIICCNG-OAHLLOKOSA-N |