5267-1726 Screening compound: 4-[5-(2-chloroquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid

5267-1726 Screening compound: 4-[5-(2-chloroquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
5267-1726 Screening compound: 4-[5-(2-chloroquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5267-1726
4-[5-(2-chloroquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

5267-1726

Molecular Formula

C23H20ClN3O3 (C23 H20 ClN3 O3)

Compound Name

4-[5-(2-chloroquinolin-3-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid

IUPAC name

4-[5-(2-chloroquinolin-3-yl)-3-(4-methylphenyl)-45-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid

SMILES

Cc(cc1)ccc1C(CC1c2cc3ccccc3nc2Cl)=NN1C(CCC(O)=O)=O

InChI

InChI=1S/C23H20ClN3O3/c1-14-6-8-15(9-7-14)19-13-20(27(26-19)21(28)10-11-22(29)30)17-12-16-4-2-3-5-18(16)25-23(17)24/h2-9,12,20H,10-11,13H2,1H3,(H,29,30)/t20-/m0/s1

InChI Key

GLZGQAMTTTWYAC-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD02989359

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.287

Distribution Coefficient, logD

1.337

Water Solubility, LogSw

-4.36

Polar Surface Area

64.211

Acid Dissociation Constant (pKa)

4.45

Base Dissociation Constant (pKb)

-3.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

5267-1726 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 5267-1726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5267-1726?
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What is the minimum amount of 5267-1726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5267-1726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5267-1726
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 5267-1726 available by request