3-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-methyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-methyl-1H-indole-2-carboxylic acid
3-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-methyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C075-0101 |
| Compound Name: | 3-{2-[2-(ethoxycarbonyl)anilino]-2-oxoethyl}-1-methyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 380.4 |
| Molecular Formula: | C21 H20 N2 O5 |
| Smiles: | CCOC(c1ccccc1NC(Cc1c2ccccc2n(C)c1C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7225 |
| logD: | 0.1909 |
| logSw: | -3.2299 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.892 |
| InChI Key: | VQOIZNZEESBBHA-UHFFFAOYSA-N |