1-(6-Bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol | CAS No. 654655-80-8

1-(6-Bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol

Basic Information

CAS Number

654655-80-8

Molecular Formula

C32H31BrN2O2

Molecular Weight

555.52 g/mol

AD

Basic Physical Properties

CN(C)CCC(C1=CC=CC2=CC=CC=C21)(C(C3=CC=CC=C3)C4=C(N=C5C=CC(=CC5=C4)Br)OC)O

InChI

InChI=1S/C32H31BrN2O2/c1-35(2)19-18-32(36,28-15-9-13-22-10-7-8-14-26(22)28)30(23-11-5-4-6-12-23)27-21-24-20-25(33)16-17-29(24)34-31(27)37-3/h4-17,20-21,30,36H,18-19H2,1-3H3

InChIKey

QUIJNHUBAXPXFS-UHFFFAOYSA-N

LogP

7.130500000000008

Topological Polar Surface Area

45.59 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

715

Synonyms & References

English

  • Bedaquiline (Mixture of Diastereomers)
  • 3-Quinolineethanol, 6-bromo-.alpha.-[2-(dimethylamino)ethyl]-2-methoxy-.alpha.-1-naphthalenyl-.beta.-phenyl-
  • BCP18281
  • (Rac)-Bedaquiline
  • 1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-naphthalen-1-yl-1-phenylbutan-2-ol
  • (1R*,2R*)-1-(6-Bromo-2-methoxy-quinolin-3-yl)-4-methyl-amino-2-naphthalen-1-yl-1-phenyl-butan-2-ol
  • (alphaR,betaS)-rel-Bedaquiline
  • 654653-93-7
  • 1-(6-bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
  • D72370
  • 6-Bromo-a-[2-(dimethylamino)ethyl]-2-methoxy-a-1-naphthalenyl-ss-phenyl-3-quinolineethanol
  • (1R*,2S*)-1-(6-Bromo-2-methoxy-quinolin-3-yl)-4-methyl-amino-2-naphthalen-1-yl-1-phenyl-butan-2-ol
  • DB-097608
  • 6-Bromo-alpha-[2-(dimethylamino)ethyl]-2-methoxy-alpha-1-naphthalenyl-beta-phenyl-3-quinolineethanol
  • CS-0009940
  • CHEMBL4068649
  • (1R,2R)-1-(6-bromo-2-methoxyquinolin-3-yl)-4-(methylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
  • 654655-80-8
  • AKOS015900657
  • cis-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
  • 843663-66-1
  • SCHEMBL296659
  • 1-(6-bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol
  • HY-14881B
  • 1-(6-bromo-2 -methoxy-quinolin-3-yl)-4-dimethylamino-2-naphtalen-1-yl-1-phenyl-butan-2-ol

MDL Number

MFCD22628872

FAQ

What regulatory guidelines apply to 1-(6-Bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol (CAS: 654655-80-8)?

This compound must comply with REACH regulations for chemical safety assessment and classification, and GHS (Globally Harmonized System of Classification and Labeling of Chemicals) for hazard communication. FDA and EPA may also require specific registration, labeling, and reporting under certain conditions. It is crucial to ensure compliance with all relevant local and international regulations.

Are there alternatives to 1-(6-Bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol (CAS: 654655-80-8) in synthesis?

Alternative reagents include 1-(6-Chloro-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol and 1-(6-Iodo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol. Isomers and analogs may also be considered based on specific synthesis requirements and desired properties.

What is the market or research trend for 1-(6-Bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol (CAS: 654655-80-8)?

The market for this compound is currently modest but growing, driven by increasing research interests in quinoline derivatives for potential pharmaceutical applications. Ongoing studies focus on its biological activity, and there is a trend towards exploring its use in drug discovery and development. Price trends are stable, reflecting consistent demand in niche markets.

How should waste containing 1-(6-Bromo-2-methoxy-3-quinolyl)-4-(dimethylamino)-2-(1-naphthyl)-1-phenyl-butan-2-ol (CAS: 654655-80-8) be handled?

Waste containing this compound should be collected in appropriate containers, ensuring proper sealing to prevent spillage. Incineration is a common disposal method, but professional waste disposal services are recommended to ensure compliance with environmental regulations. Precautions include handling waste under controlled conditions to prevent environmental contamination and ensuring all safety protocols are followed.

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