5-oxo-3-phenyl-7-(3-propoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Chemical Structure Depiction of
5-oxo-3-phenyl-7-(3-propoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
5-oxo-3-phenyl-7-(3-propoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Compound characteristics
| Compound ID: | D562-0091 |
| Compound Name: | 5-oxo-3-phenyl-7-(3-propoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C23 H21 N O4 S |
| Smiles: | CCCOc1cccc(c1)C1CC(Nc2c(c3ccccc3)c(C(O)=O)sc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.477 |
| logD: | 2.6769 |
| logSw: | -4.3347 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.108 |
| InChI Key: | NZTUJPIMKKQDSD-QGZVFWFLSA-N |