5-chloro-3-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
5-chloro-3-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid
5-chloro-3-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C289-0255 |
| Compound Name: | 5-chloro-3-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid |
| Molecular Weight: | 388.81 |
| Molecular Formula: | C19 H17 Cl N2 O5 |
| Smiles: | COc1ccc(cc1OC)NC(Cc1c2cc(ccc2[nH]c1C(O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6192 |
| logD: | 0.0648 |
| logSw: | -3.0453 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.905 |
| InChI Key: | DGZVUSKKPSWUSO-UHFFFAOYSA-N |