G334-0548 Screening compound: 1-(1,2-dimethyl-1H-indol-3-yl)-2-{[1-(4-ethylphenyl)-3,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}ethan-1-one

G334-0548 Screening compound: 1-(1,2-dimethyl-1H-indol-3-yl)-2-{[1-(4-ethylphenyl)-3,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}ethan-1-one
G334-0548 Screening compound: 1-(1,2-dimethyl-1H-indol-3-yl)-2-{[1-(4-ethylphenyl)-3,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G334-0548
1-(1,2-dimethyl-1H-indol-3-yl)-2-{[1-(4-ethylphenyl)-3,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}ethan-1-one

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

G334-0548

Molecular Formula

C28H28N4O2 (C28 H28 N4 O2)

Compound Name

1-(1,2-dimethyl-1H-indol-3-yl)-2-{[1-(4-ethylphenyl)-3,4-dimethyl-1H-pyrazolo[3,4-b]pyridin-6-yl]oxy}ethan-1-one

IUPAC name

1-(12-dimethyl-1H-indol-3-yl)-2-{[1-(4-ethylphenyl)-34-dimethyl-1H-pyrazolo[34-b]pyridin-6-yl]oxy}ethan-1-one

SMILES

CCc(cc1)ccc1-n1nc(C)c(c(C)c2)c1nc2OCC(c1c(C)n(C)c2c1cccc2)=O

InChI

InChI=1S/C28H28N4O2/c1-6-20-11-13-21(14-12-20)32-28-26(18(3)30-32)17(2)15-25(29-28)34-16-24(33)27-19(4)31(5)23-10-8-7-9-22(23)27/h7-15H,6,16H2,1-5H3

InChI Key

WRBZSDIEMFAPJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27135607

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.56

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.933

Distribution Coefficient, logD

5.933

Water Solubility, LogSw

-6.00

Polar Surface Area

46.291

Acid Dissociation Constant (pKa)

17.37

Base Dissociation Constant (pKb)

-0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

G334-0548 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with G334-0548 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G334-0548?
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What is the minimum amount of G334-0548 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G334-0548
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G334-0548
  • 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 G334-0548 available by request