7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-3-phenyl-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Chemical Structure Depiction of
7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-3-phenyl-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-3-phenyl-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid
Compound characteristics
| Compound ID: | 8019-6603 |
| Compound Name: | 7-{3-methoxy-2-[(prop-2-en-1-yl)oxy]phenyl}-5-oxo-3-phenyl-4,5,6,7-tetrahydrothieno[3,2-b]pyridine-2-carboxylic acid |
| Molecular Weight: | 435.5 |
| Molecular Formula: | C24 H21 N O5 S |
| Smiles: | COc1cccc(C2CC(Nc3c(c4ccccc4)c(C(O)=O)sc23)=O)c1OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9715 |
| logD: | 2.1715 |
| logSw: | -4.3658 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.912 |
| InChI Key: | GROROKZJBYQEDS-MRXNPFEDSA-N |