3-(4-chlorophenyl)-7-{3-methoxy-2-[(propan-2-yl)oxy]phenyl}-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-{3-methoxy-2-[(propan-2-yl)oxy]phenyl}-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
3-(4-chlorophenyl)-7-{3-methoxy-2-[(propan-2-yl)oxy]phenyl}-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Compound characteristics
| Compound ID: | D562-0204 |
| Compound Name: | 3-(4-chlorophenyl)-7-{3-methoxy-2-[(propan-2-yl)oxy]phenyl}-5-oxo-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid |
| Molecular Weight: | 471.96 |
| Molecular Formula: | C24 H22 Cl N O5 S |
| Smiles: | CC(C)Oc1c(cccc1OC)C1CC(Nc2c(c3ccc(cc3)[Cl])c(C(O)=O)sc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.769 |
| logD: | 2.969 |
| logSw: | -4.7274 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.297 |
| InChI Key: | NBSNKYPGXQXYBL-INIZCTEOSA-N |