5-{[6-tert-butyl-3-(ethoxycarbonyl)-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
Chemical Structure Depiction of
5-{[6-tert-butyl-3-(ethoxycarbonyl)-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
5-{[6-tert-butyl-3-(ethoxycarbonyl)-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
Compound characteristics
| Compound ID: | Y200-3902 |
| Compound Name: | 5-{[6-tert-butyl-3-(ethoxycarbonyl)-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid |
| Molecular Weight: | 391.48 |
| Molecular Formula: | C20 H25 N O5 S |
| Smiles: | CCOC(c1c2ccc(cc2sc1NC(CCCC(O)=O)=O)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6674 |
| logD: | 1.0702 |
| logSw: | -4.2286 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.048 |
| InChI Key: | JNYSEZQFJXLYOQ-UHFFFAOYSA-N |