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| IUPAC Name: | 5-chloro-1-[(4-chlorophenyl)methyl]-3-phenylsulfanylindole-2-carboxylic acid |
| Description: | 5-Chloro-1-(4-chlorobenzyl)-3-(phenylthio)-2-indolecarboxylic Acid (CAS# 118414-59-8) is a PPARγ agonist, with pharmaceutical applications such as anti-diabetic drugs. |
| Molecular Weight: | 428.33 |
| Molecular Formula: | C22H15Cl2NO2S |
| Canonical SMILES: | C1=CC=C(C=C1)SC2=C(N(C3=C2C=C(C=C3)Cl)CC4=CC=C(C=C4)Cl)C(=O)O |
| InChI: | InChI=1S/C22H15Cl2NO2S/c23-15-8-6-14(7-9-15)13-25-19-11-10-16(24)12-18(19)21(20(25)22(26)27)28-17-4-2-1-3-5-17/h1-12H,13H2,(H,26,27) |
| InChI Key: | VUPOTURDKDMIGQ-UHFFFAOYSA-N |
| Boiling Point: | 628.9 °C at 760 mmHg |
| Density: | 1.37 g/cm3 |
| LogP: | 6.84580 |
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