heptyl 6-(4-tert-butylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
heptyl 6-(4-tert-butylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
heptyl 6-(4-tert-butylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
Compound ID: | C276-0406 |
Compound Name: | heptyl 6-(4-tert-butylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
Molecular Weight: | 423.6 |
Molecular Formula: | C27 H37 N O3 |
Smiles: | CCCCCCCOC(c1c(C)c2C(CC(Cc2[nH]1)c1ccc(cc1)C(C)(C)C)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 7.8332 |
logD: | 7.8332 |
logSw: | -5.9259 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.089 |
InChI Key: | ICKGEVXARDSLSW-HXUWFJFHSA-N |