Aripiprazole impurity 38

Name: Aripiprazole impurity 38
Brand: ChemScene
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CAS No. 30389-33-4
Cat. No. CS-0059153
Purity≥96%
MDL No.MFCD01862194

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FedEx Limited Quantities Ground	$0.00
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Structure of 30389-33-4

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General Information

CAS No. 30389-33-4
Cat. No. CS-0059153
Purity ≥96%
MDL No. MFCD01862194
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉NO₂
Molecular Weight 163.18
Synonym(s) None
SMILES O=C1NC=2C=CC=C(O)C2CC1

Description

5-Hydroxy-3,4-dihydroquinolin-2(1H)-one features a fused heterocyclic core with a hydroxyl group at the 5-position and a lactam carbonyl at C2, offering enhanced solubility and hydrogen-bonding capacity. This scaffold integrates readily into medicinal chemistry libraries, where its polarity and structural rigidity support target engagement in kinase inhibition and receptor modulation pathways.

Application

5-Hydroxy-3,4-dihydroquinolin-2(1H)-one serves as a versatile scaffold in medicinal chemistry, enabling efficient access to biologically relevant heterocycles. Its hydroxyl and lactam functionalities provide sites for derivatization, while the dihydroquinoline core exhibits favorable stability and compatibility with standard coupling and functional group transformation protocols. This compound functions as a key intermediate in the synthesis of potential kinase inhibitors and other bioactive molecules.

Synthesis

Route1
- 21261-76-7
- ~0%
- 22246-18-0
- In-stock
  
  30389-33-4
References
- Naddaka, Vladimir; Davidi, Guy; Klopfer, Eyal; Arad, Oded; Kaspi, Joseph Patent: US2006/79690 A1, 2006 ; Location in patent: Page/Page column 6 ;
Route2
- In-stock
  
  5057-12-5
- ~73%
- In-stock
  
  31570-97-5
- In-stock
  
  30389-33-4
References
- Shono, Tatsuya; Matsumura, Yoshihiro; Kashimura, Shigenori Journal of Organic Chemistry, 1981 , vol. 46, # 18 p. 3719
Route3
- In-stock
  
  30557-06-3
- ~%
- In-stock
  
  30389-33-4
References
- Bioorganic and Medicinal Chemistry Letters, , vol. 20, # 23 p. 7092 - 7096

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 49.33
LogP 1.2769
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Tetrahydroquinoline compounds

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Aripiprazole impurity 38

CAS No. 30389-33-4

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