G812-0991 Screening compound: 4-{3-BENZYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL}-1-[4-(2,5-DIMETHYLPHENYL)PIPERAZIN-1-YL]BUTAN-1-ONE

G812-0991 Screening compound: 4-{3-BENZYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL}-1-[4-(2,5-DIMETHYLPHENYL)PIPERAZIN-1-YL]BUTAN-1-ONE
G812-0991 Screening compound: 4-{3-BENZYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL}-1-[4-(2,5-DIMETHYLPHENYL)PIPERAZIN-1-YL]BUTAN-1-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound G812-0991
4-{3-BENZYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL}-1-[4-(2,5-DIMETHYLPHENYL)PIPERAZIN-1-YL]BUTAN-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

G812-0991

Molecular Formula

C29H33N5O (C29 H33 N5 O)

Compound Name

4-{3-BENZYL-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL}-1-[4-(2,5-DIMETHYLPHENYL)PIPERAZIN-1-YL]BUTAN-1-ONE

IUPAC name

n/a

SMILES

Cc1cc(N(CC2)CCN2C(CCCc(n2Cc3ccccc3)nc3c2nccc3)=O)c(C)cc1

InChI

InChI=1S/C29H33N5O/c1-22-13-14-23(2)26(20-22)32-16-18-33(19-17-32)28(35)12-6-11-27-31-25-10-7-15-30-29(25)34(27)21-24-8-4-3-5-9-24/h3-5,7-10,13-15,20H,6,11-12,16-19,21H2,1-2H3

InChI Key

QHXGTRVQYDSFPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27162985

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.61

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.988

Distribution Coefficient, logD

4.988

Water Solubility, LogSw

-4.67

Polar Surface Area

40.130

Acid Dissociation Constant (pKa)

19.49

Base Dissociation Constant (pKb)

4.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.50

G812-0991 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Epigenetics Focused Set (26518 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
  • Kinases
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G812-0991 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G812-0991?
Check Price and Availability of G812-0991, 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 G812-0991 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G812-0991
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G812-0991
  • 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 G812-0991 available by request