2-ethylbutyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
2-ethylbutyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
2-ethylbutyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
Compound ID: | C276-0876 |
Compound Name: | 2-ethylbutyl 3-methyl-4-oxo-6-phenyl-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
Molecular Weight: | 353.46 |
Molecular Formula: | C22 H27 N O3 |
Smiles: | CCC(CC)COC(c1c(C)c2C(CC(Cc2[nH]1)c1ccccc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.3496 |
logD: | 5.3496 |
logSw: | -5.7471 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.17 |
InChI Key: | PORYEONLDFRXJG-QGZVFWFLSA-N |