7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Chemical Structure Depiction of
7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid
Compound characteristics
Compound ID: | 8020-2971 |
Compound Name: | 7-(7-methoxy-2H-1,3-benzodioxol-5-yl)-1-(3-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-b]pyridine-3-carboxylic acid |
Molecular Weight: | 436.42 |
Molecular Formula: | C23 H20 N2 O7 |
Smiles: | COc1cccc(c1)n1cc(C(O)=O)c2c1C(CC(N2)=O)c1cc(c2c(c1)OCO2)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3809 |
logD: | -0.4063 |
logSw: | -3.6962 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.247 |
InChI Key: | PBRQSYIYZNRDFP-HNNXBMFYSA-N |