3-formyl-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-formyl-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
3-formyl-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C800-0006 |
| Compound Name: | 3-formyl-1-[(4-methylphenyl)methyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 293.32 |
| Molecular Formula: | C18 H15 N O3 |
| Smiles: | Cc1ccc(Cn2c(C(O)=O)c(C=O)c3ccccc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2586 |
| logD: | -0.7549 |
| logSw: | -2.9795 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.036 |
| InChI Key: | MSGSQSGYWXIHAC-UHFFFAOYSA-N |