ethyl 6,6-dimethyl-3-[(2-methylphenyl)methyl]-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Chemical Structure Depiction of
ethyl 6,6-dimethyl-3-[(2-methylphenyl)methyl]-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
ethyl 6,6-dimethyl-3-[(2-methylphenyl)methyl]-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Compound characteristics
| Compound ID: | C276-0592 |
| Compound Name: | ethyl 6,6-dimethyl-3-[(2-methylphenyl)methyl]-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate |
| Molecular Weight: | 339.43 |
| Molecular Formula: | C21 H25 N O3 |
| Smiles: | CCOC(c1c(Cc2ccccc2C)c2C(CC(C)(C)Cc2[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5087 |
| logD: | 4.5087 |
| logSw: | -4.5198 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.794 |
| InChI Key: | KGVVFLVCYLZDAS-UHFFFAOYSA-N |