3-formyl-1-[(2,4,6-trimethylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-formyl-1-[(2,4,6-trimethylphenyl)methyl]-1H-indole-2-carboxylic acid
3-formyl-1-[(2,4,6-trimethylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C800-0061 |
| Compound Name: | 3-formyl-1-[(2,4,6-trimethylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C20 H19 N O3 |
| Smiles: | Cc1cc(C)c(Cn2c(C(O)=O)c(C=O)c3ccccc23)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.3903 |
| logD: | 0.3768 |
| logSw: | -4.245 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.036 |
| InChI Key: | HJQVVGHNUHBZMW-UHFFFAOYSA-N |