1-[(2,5-dimethylphenyl)methyl]-3-formyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
1-[(2,5-dimethylphenyl)methyl]-3-formyl-1H-indole-2-carboxylic acid
1-[(2,5-dimethylphenyl)methyl]-3-formyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C800-0060 |
| Compound Name: | 1-[(2,5-dimethylphenyl)methyl]-3-formyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 307.35 |
| Molecular Formula: | C19 H17 N O3 |
| Smiles: | Cc1ccc(C)c(Cn2c(C(O)=O)c(C=O)c3ccccc23)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.0189 |
| logD: | 0.0054 |
| logSw: | -3.938 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.036 |
| InChI Key: | YVVVFQXSOPFZIX-UHFFFAOYSA-N |