7-[4-(methoxycarbonyl)phenyl]-3-(4-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Chemical Structure Depiction of
7-[4-(methoxycarbonyl)phenyl]-3-(4-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
7-[4-(methoxycarbonyl)phenyl]-3-(4-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Compound characteristics
| Compound ID: | D562-0546 |
| Compound Name: | 7-[4-(methoxycarbonyl)phenyl]-3-(4-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid |
| Molecular Weight: | 437.47 |
| Molecular Formula: | C23 H19 N O6 S |
| Smiles: | COC(c1ccc(cc1)C1CC(Nc2c(c3ccc(cc3)OC)c(C(O)=O)sc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6204 |
| logD: | 1.8203 |
| logSw: | -4.0134 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.408 |
| InChI Key: | CTODMOHQKDCNHE-MRXNPFEDSA-N |