G831-0003 Screening compound: N-({3-benzyl-3H-imidazo[4,5-b]pyridin-2-yl}methyl)-4-(diethylamino)benzamide

G831-0003 Screening compound: N-({3-benzyl-3H-imidazo[4,5-b]pyridin-2-yl}methyl)-4-(diethylamino)benzamide
G831-0003 Screening compound: N-({3-benzyl-3H-imidazo[4,5-b]pyridin-2-yl}methyl)-4-(diethylamino)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G831-0003
N-({3-benzyl-3H-imidazo[4,5-b]pyridin-2-yl}methyl)-4-(diethylamino)benzamide

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

G831-0003

Molecular Formula

C25H27N5O (C25 H27 N5 O)

Compound Name

N-({3-benzyl-3H-imidazo[4,5-b]pyridin-2-yl}methyl)-4-(diethylamino)benzamide

IUPAC name

N-({3-benzyl-3H-imidazo[45-b]pyridin-2-yl}methyl)-4-(diethylamino)benzamide

SMILES

CCN(CC)c(cc1)ccc1C(NCc(n1Cc2ccccc2)nc2c1nccc2)=O

InChI

InChI=1S/C25H27N5O/c1-3-29(4-2)21-14-12-20(13-15-21)25(31)27-17-23-28-22-11-8-16-26-24(22)30(23)18-19-9-6-5-7-10-19/h5-16H,3-4,17-18H2,1-2H3,(H,27,31)

InChI Key

REZVFRCVATZNTP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27163716

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.52

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.169

Distribution Coefficient, logD

4.166

Water Solubility, LogSw

-4.08

Polar Surface Area

48.199

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

8.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

G831-0003 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Targeted Diversity Library (40567 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with G831-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G831-0003?
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What is the minimum amount of G831-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G831-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G831-0003
  • 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 G831-0003 available by request