G831-0216 Screening compound: 4-(diethylamino)-N-({3-[(3-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide

G831-0216 Screening compound: 4-(diethylamino)-N-({3-[(3-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide
G831-0216 Screening compound: 4-(diethylamino)-N-({3-[(3-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G831-0216
4-(diethylamino)-N-({3-[(3-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}methyl)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

G831-0216

Molecular Formula

C26H29N5O2 (C26 H29 N5 O2)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC)c(cc1)ccc1C(NCc(n1Cc2cc(OC)ccc2)nc2c1nccc2)=O

InChI

InChI=1S/C26H29N5O2/c1-4-30(5-2)21-13-11-20(12-14-21)26(32)28-17-24-29-23-10-7-15-27-25(23)31(24)18-19-8-6-9-22(16-19)33-3/h6-16H,4-5,17-18H2,1-3H3,(H,28,32)

InChI Key

QDQZMTMJQJOHKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27163840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.224

Distribution Coefficient, logD

4.222

Water Solubility, LogSw

-4.29

Polar Surface Area

55.743

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

8.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.90

G831-0216 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 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 G831-0216 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G831-0216?
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What is the minimum amount of G831-0216 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G831-0216
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G831-0216
  • 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 G831-0216 available by request