benzyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
benzyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
benzyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
Compound ID: | C276-0826 |
Compound Name: | benzyl 3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
Molecular Weight: | 449.5 |
Molecular Formula: | C26 H27 N O6 |
Smiles: | Cc1c2C(CC(Cc2[nH]c1C(=O)OCc1ccccc1)c1cc(c(c(c1)OC)OC)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.1246 |
logD: | 4.1246 |
logSw: | -4.6938 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.876 |
InChI Key: | BHXWZYRMBFHWMU-QGZVFWFLSA-N |