5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID
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![5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/165c074d9924428aaaabaec6a72ee504.png "5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID")
5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID
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CAS No:
118414-59-8
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Formula:
C22H15Cl2NO2S
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Chemical Name:
5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID
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Synonyms:
NTZDPA;5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID
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CAS No:
5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID Basic Attributes
428.33
427.02
DTXSID40433292
Characteristics
67.5
6.8
white to beige
1.37g/cm3
628.9ºC at 760mmHg
334.2ºC
1.672
DMSO: soluble15mg/mL, clear
Store at +4°C
0mmHg at 25°C
5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID Use and Manufacturing
nTZDpa is a PPARγ agonist, with pharmaceutical applications such as anti-diabetic drugs.
Computed Properties
Molecular Weight:428.3
XLogP3:6.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:427.0200553
Monoisotopic Mass:427.0200553
Topological Polar Surface Area:67.5
Heavy Atom Count:28
Complexity:537
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-CHLORO-1-[(4-CHLOROPHENYL)METHYL]-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID
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