3-{2-[(4-bromophenyl)(methyl)amino]-2-oxoethyl}-5-chloro-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-{2-[(4-bromophenyl)(methyl)amino]-2-oxoethyl}-5-chloro-1H-indole-2-carboxylic acid
3-{2-[(4-bromophenyl)(methyl)amino]-2-oxoethyl}-5-chloro-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C289-0382 |
| Compound Name: | 3-{2-[(4-bromophenyl)(methyl)amino]-2-oxoethyl}-5-chloro-1H-indole-2-carboxylic acid |
| Molecular Weight: | 421.68 |
| Molecular Formula: | C18 H14 Br Cl N2 O3 |
| Smiles: | CN(C(Cc1c2cc(ccc2[nH]c1C(O)=O)[Cl])=O)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5389 |
| logD: | 0.9845 |
| logSw: | -3.8621 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.608 |
| InChI Key: | PGYMELVSAYGXRT-UHFFFAOYSA-N |