3-(4-fluorophenyl)-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-fluorophenyl)-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-fluorophenyl)-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: | D562-0436 |
Compound Name: | 3-(4-fluorophenyl)-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: | 455.5 |
Molecular Formula: | C24 H22 F N O5 S |
Smiles: | CC(C)Oc1c(cccc1OC)C1CC(Nc2c(c3ccc(cc3)F)c(C(O)=O)sc12)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.2034 |
logD: | 2.4033 |
logSw: | -4.4762 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.297 |
InChI Key: | PYQRQXFSFCHGKV-MRXNPFEDSA-N |