butan-2-yl 6-(4-ethylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
butan-2-yl 6-(4-ethylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
butan-2-yl 6-(4-ethylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C276-0428 |
| Compound Name: | butan-2-yl 6-(4-ethylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
| Molecular Weight: | 353.46 |
| Molecular Formula: | C22 H27 N O3 |
| Smiles: | CCC(C)OC(c1c(C)c2C(CC(Cc2[nH]1)c1ccc(CC)cc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6095 |
| logD: | 5.6095 |
| logSw: | -5.576 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.357 |
| InChI Key: | JRBGPVDIILVQAL-UHFFFAOYSA-N |