G219-4060 Screening compound: N-benzyl-2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamide

G219-4060 Screening compound: N-benzyl-2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamide
G219-4060 Screening compound: N-benzyl-2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G219-4060
N-benzyl-2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamide

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

G219-4060

Molecular Formula

C24H20ClF3N4O2 (C24 H20 ClF3 N4 O2)

Compound Name

N-benzyl-2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}acetamide

IUPAC name

N-benzyl-2-{[1-(3-chloro-2-methylphenyl)-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[34-b]pyridin-6-yl]oxy}acetamide

SMILES

Cc(c(c1n2)c(C(F)(F)F)cc2OCC(NCc2ccccc2)=O)nn1-c1cccc(Cl)c1C

InChI

InChI=1S/C24H20ClF3N4O2/c1-14-18(25)9-6-10-19(14)32-23-22(15(2)31-32)17(24(26,27)28)11-21(30-23)34-13-20(33)29-12-16-7-4-3-5-8-16/h3-11H,12-13H2,1-2H3,(H,29,33)

InChI Key

MBQJVTABSCJMMQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27211338

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

488.9

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.616

Distribution Coefficient, logD

5.616

Water Solubility, LogSw

-5.84

Polar Surface Area

54.933

Acid Dissociation Constant (pKa)

13.23

Base Dissociation Constant (pKb)

-0.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

G219-4060 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with G219-4060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G219-4060?
Check Price and Availability of G219-4060, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G219-4060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G219-4060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G219-4060
  • 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 G219-4060 available by request