4-{[6-tert-butyl-3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Chemical Structure Depiction of
4-{[6-tert-butyl-3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
4-{[6-tert-butyl-3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 4488-1951 |
| Compound Name: | 4-{[6-tert-butyl-3-(ethoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid |
| Molecular Weight: | 381.49 |
| Molecular Formula: | C19 H27 N O5 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(CCC(O)=O)=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4387 |
| logD: | 0.4892 |
| logSw: | -3.5795 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.24 |
| InChI Key: | QQXQGNPOHNNPGG-LLVKDONJSA-N |