65277-42-1,MFCD00058579
Catalog No.:AA0034ZV

65277-42-1 | 1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$27.00   $19.00
- +
25g
98%
in stock  
$43.00   $30.00
- +
100g
98%
in stock  
$107.00   $75.00
- +
500g
98%
in stock  
$393.00 $275.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0034ZV
Chemical Name:
1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one
CAS Number:
65277-42-1
Molecular Formula:
C26H28Cl2N4O4
Molecular Weight:
531.4309
MDL Number:
MFCD00058579
SMILES:
Clc1ccc(c(c1)Cl)[C@@]1(OC[C@H](O1)COc1ccc(cc1)N1CCN(CC1)C(=O)C)Cn1cncc1
UN Number:
2811
Properties
Properties
 
BP:
753.4 °C at 760 mmHg  
Form:
Solid  
MP:
146 °C  
Refractive Index:
-10.5 ° (C=0.4, CHCl3)  
Solubility:
methanol: soluble50mg/mL  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
735  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.3  

Literature

Title: Seif El-Din SH, et al. Effect of ketoconazole, a cytochrome P450 inhibitor, on the efficacy of quinine and halofantrine against Schistosoma mansoni in mice. Korean J Parasitol. 2013 Apr;51(2):165-75.

Title: Eil C. Ketoconazole binds to the human androgen receptor. Horm Metab Res. 1992 Aug;24(8):367-70.

Title: Muindi JR et al. CYP24A1 inhibition enhances the antitumor activity of calcitriol. Endocrinology. 2010 Sep;151(9):4301-12.

Title: Amrita Datta, et al. High-throughput screening identified selective inhibitors of exosome biogenesis and secretion: A drug repurposing strategy for advanced cancer. Sci Rep. 2018 May 25;8(1):8161.

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SDS
Historical Records
Tags:65277-42-1 Molecular Formula|65277-42-1 MDL|65277-42-1 SMILES|65277-42-1 1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one
Catalog No.: AA0034ZV
65277-42-1,MFCD00058579
65277-42-1 | 1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one
Pack Size: 5g
Purity: 98%
in stock
$27.00 $19.00
Pack Size: 25g
Purity: 98%
in stock
$43.00 $30.00
Pack Size: 100g
Purity: 98%
in stock
$107.00 $75.00
Pack Size: 500g
Purity: 98%
in stock
$393.00 $275.00
Quantity
- +
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Technical Information
Catalog Number: AA0034ZV
Chemical Name: 1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one
CAS Number: 65277-42-1
Molecular Formula: C26H28Cl2N4O4
Molecular Weight: 531.4309
MDL Number: MFCD00058579
SMILES: Clc1ccc(c(c1)Cl)[C@@]1(OC[C@H](O1)COc1ccc(cc1)N1CCN(CC1)C(=O)C)Cn1cncc1
UN Number: 2811
Properties
BP: 753.4 °C at 760 mmHg  
Form: Solid  
MP: 146 °C  
Refractive Index: -10.5 ° (C=0.4, CHCl3)  
Solubility: methanol: soluble50mg/mL  
Storage: Keep in dry area;-20 ℃;  
Complexity: 735  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 2  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 36  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 7  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.3  
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