7-(4-carboxyphenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Chemical Structure Depiction of
7-(4-carboxyphenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
7-(4-carboxyphenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Compound characteristics
| Compound ID: | D562-0197 |
| Compound Name: | 7-(4-carboxyphenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid |
| Molecular Weight: | 427.86 |
| Molecular Formula: | C21 H14 Cl N O5 S |
| Smiles: | C1C(c2ccc(cc2)C(O)=O)c2c(c(c3ccc(cc3)[Cl])c(C(O)=O)s2)NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9902 |
| logD: | 1.0187 |
| logSw: | -4.9204 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.099 |
| InChI Key: | BRCXUOROPSCKCS-AWEZNQCLSA-N |