7-(2-chlorophenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Chemical Structure Depiction of
7-(2-chlorophenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
7-(2-chlorophenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Compound characteristics
Compound ID: | D562-0181 |
Compound Name: | 7-(2-chlorophenyl)-3-(4-chlorophenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid |
Molecular Weight: | 418.3 |
Molecular Formula: | C20 H13 Cl2 N O3 S |
Smiles: | C1C(c2ccccc2[Cl])c2c(c(c3ccc(cc3)[Cl])c(C(O)=O)s2)NC1=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.756 |
logD: | 2.9559 |
logSw: | -4.6792 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 51.691 |
InChI Key: | USPGASWCZAEIGZ-CYBMUJFWSA-N |