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22232-71-9 molecular structure
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5-(4-chlorophenyl)-2H,3H,5H-imidazo[2,1-a]isoindol-5-ol

ChemBase ID: 172559
Molecular Formular: C16H13ClN2O
Molecular Mass: 284.74022
Monoisotopic Mass: 284.07164073
SMILES and InChIs

SMILES:
c1ccc2c(c1)C(N1C2=NCC1)(c1ccc(cc1)Cl)O
Canonical SMILES:
Clc1ccc(cc1)C1(O)c2ccccc2C2=NCCN12
InChI:
InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2
InChIKey:
ZPXSCAKFGYXMGA-UHFFFAOYSA-N

Cite this record

CBID:172559 http://www.chembase.cn/molecule-172559.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
5-(4-chlorophenyl)-2H,3H,5H-imidazo[2,1-a]isoindol-5-ol
IUPAC Traditional name
mazindol
Synonyms
5-(4-Chlorophenyl)-2,5-dihydro-3H-imidazo[2,1-a]isoindol-5-ol
5-(4-Chlorophenyl)-2,3-dihydro-5-hydroxy-5H-imidazo[2,1-a]isoindole
5-Hydroxy-5-p-chlorophenyl-2,3-dihydro-5H-imidazo[2,1-a]isoindole
AN 448
Magrilon
Mazanor
Mazildene
Mazindol
SaH 42548
Sanorex
Terenac
Teronac
Mazindol
CAS Number
22232-71-9
PubChem SID
164228469
PubChem CID
4020

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
TRC M198500 external link Add to cart
PubChem 4020 external link
Data Source Data ID Price
TRC
M198500 external link Add to cart Please log in.
Data Source Data ID
PubChem 4020 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Lipinski's Rule of Five true  Acid pKa 11.61332 
H Acceptors H Donor
LogD (pH = 5.5) 3.4254982  LogD (pH = 7.4) 3.435128 
Log P 3.435279  Molar Refractivity 79.4221 cm3
Polarizability 30.142792 Å3 Polar Surface Area 35.83 Å2
Rotatable Bonds

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
DMSO expand Show data source
Methanol expand Show data source
Apperance
White Solid expand Show data source
Melting Point
178-180°C expand Show data source
Storage Condition
Controlled Substance, -20°C Freezer expand Show data source
MSDS Link
Download expand Show data source
Certificate of Analysis
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DETAILS

DETAILS

TRC TRC
Toronto Research Chemicals - M198500 external link
Clinical trials as appetite depressant. Anorexic; CNS stimulant. Controlled substance (stimulant).

REFERENCES

REFERENCES

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  • • Sirtori, C., et al.: Am. J. Med. Sci., 261, 341 (1971)
  • • Hadler, A.J., et al.: J. Clin. Pharmacol., 12, 453 (1971)
  • • Thompson, D.A., et al.: Metabolism., 30, 1015 (1971)
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PATENTS

PATENTS

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INTERNET

INTERNET

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