3-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,5-dimethyl-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,5-dimethyl-1H-indole-2-carboxylic acid
3-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,5-dimethyl-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C294-1194 |
| Compound Name: | 3-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-1,5-dimethyl-1H-indole-2-carboxylic acid |
| Molecular Weight: | 374.8 |
| Molecular Formula: | C19 H16 Cl F N2 O3 |
| Smiles: | Cc1ccc2c(c1)c(CC(Nc1ccc(c(c1)[Cl])F)=O)c(C(O)=O)n2C |
| Stereo: | ACHIRAL |
| logP: | 3.849 |
| logD: | 1.3175 |
| logSw: | -3.9784 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.836 |
| InChI Key: | SMVXDSWHWSUEFJ-UHFFFAOYSA-N |