1-(3-chlorophenyl)-7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Chemical Structure Depiction of
1-(3-chlorophenyl)-7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
1-(3-chlorophenyl)-7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Compound characteristics
| Compound ID: | 8020-2966 |
| Compound Name: | 1-(3-chlorophenyl)-7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid |
| Molecular Weight: | 440.84 |
| Molecular Formula: | C22 H17 Cl N2 O6 |
| Smiles: | COc1cc(cc2c1OCO2)C1CC(Nc2c(cn(c3cccc(c3)[Cl])c12)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8565 |
| logD: | 0.0694 |
| logSw: | -4.1625 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.703 |
| InChI Key: | GYMAGDJXESLQSS-CQSZACIVSA-N |