5-chloro-3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
5-chloro-3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-indole-2-carboxylic acid
5-chloro-3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-indole-2-carboxylic acid
Compound characteristics
| Compound ID: | C289-0406 |
| Compound Name: | 5-chloro-3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-indole-2-carboxylic acid |
| Molecular Weight: | 446.33 |
| Molecular Formula: | C22 H21 Cl2 N3 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(Cc1c2cc(ccc2[nH]c1C(O)=O)[Cl])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3279 |
| logD: | 1.7735 |
| logSw: | -4.3454 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.846 |
| InChI Key: | BKWILOGXOBSSPK-UHFFFAOYSA-N |