DRL-17822 - Moligand™, ≥98% , Inhibitor of Liver X receptor-α, CAS No.898911-09-6, Inhibitor of Liver X receptor-α

CAS: 898911-09-6 Cat. No.: D609972 Formula: C₃₀H₃₁F₆N₇ Molecular Weight: 603.60 PubChem CID: 58689743

GRADE & PURITY Moligand™, ≥98%

Synonyms

3-[[[3,5-bis(trifluoromethyl)phenyl]methyl-(2-methyltetrazol-5-yl)amino]methyl]-N,N-bis(cyclopropylmethyl)-8-methylquinolin-2-amine | 2-(Bis(cyclopropylmethyl)amino)-N-((3,5-bis(trifluoromethyl)phenyl)methyl)-8-methyl-N-(2-methyl-2H-tetrazol-5-yl)-3-quino

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

DRL-17822 is a Cholesteryl Ester Transfer Protein (CETP) inhibitor.

Specifications

Synonyms

3-[[[3,5-bis(trifluoromethyl)phenyl]methyl-(2-methyltetrazol-5-yl)amino]methyl]-N,N-bis(cyclopropylmethyl)-8-methylquinolin-2-amine | 2-(Bis(cyclopropylmethyl)amino)-N-((3,5-bis(trifluoromethyl)phenyl)methyl)-8-methyl-N-(2-methyl-2H-tetrazol-5-yl)-3-quino

Specifications & Purity

Moligand™, ≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

INHIBITOR

Mechanism of action

Inhibitor of Liver X receptor-α

Purity

≥98%

Names and Identifiers

• Canonical Smiles: Cn1nnc(n1)N(Cc1cc2cccc(c2nc1N(CC1CC1)CC1CC1)C)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F
• IUPAC Name: 3-[[[3,5-bis(trifluoromethyl)phenyl]methyl-(2-methyltetrazol-5-yl)amino]methyl]-N,N-bis(cyclopropylmethyl)-8-methylquinolin-2-amine
• InChIKey: OCNBSSLDAIWTKS-UHFFFAOYSA-N
• INCHI: 1S/C30H31F6N7/c1-18-4-3-5-22-12-23(27(37-26(18)22)42(14-19-6-7-19)15-20-8-9-20)17-43(28-38-40-41(2)39-28)16-21-10-24(29(31,32)33)13-25(11-21)30(34,35)36/h3-5,10-13,19-20H,6-9,14-17H2,1-2H3
• Isomeric SMILES: CC1=C2C(=CC=C1)C=C(C(=N2)N(CC3CC3)CC4CC4)CN(CC5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F)C6=NN(N=N6)C
• PubChem CID: 58689743
• Molecular Weight: 603.60

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Quinolines and derivatives
      • Subclass Aminoquinolines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Quinolines and derivatives
• Subclass: Aminoquinolines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminoquinolines and derivatives
• Alternative Parents: Trifluoromethylbenzenes Dialkylarylamines Benzylamines Aminopyridines and derivatives Imidolactams Tetrazoles Heteroaromatic compounds Azacyclic compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Aminoquinoline - Trifluoromethylbenzene - Dialkylarylamine - Benzylamine - Aminopyridine - Imidolactam - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Tetrazole - Azole - Tertiary amine - Azacycle - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Alkyl halide - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as aminoquinolines and derivatives. These are organic compounds containing an amino group attached to a quinoline ring system.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

NR1H3 Tchem Oxysterols receptor LXR-alpha (0 Activities)

Discover Target: NR1H3

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)