M477-0453 Screening compound: 2,5-difluoro-N-(2-{3-propyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide

M477-0453 Screening compound: 2,5-difluoro-N-(2-{3-propyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide
M477-0453 Screening compound: 2,5-difluoro-N-(2-{3-propyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M477-0453
2,5-difluoro-N-(2-{3-propyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)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

M477-0453

Molecular Formula

C18H18F2N4O (C18 H18 F2 N4 O)

Compound Name

2,5-difluoro-N-(2-{3-propyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)benzamide

IUPAC name

25-difluoro-N-(2-{3-propyl-3H-imidazo[45-b]pyridin-2-yl}ethyl)benzamide

SMILES

CCCn1c(nccc2)c2nc1CCNC(c(cc(cc1)F)c1F)=O

InChI

InChI=1S/C18H18F2N4O/c1-2-10-24-16(23-15-4-3-8-21-17(15)24)7-9-22-18(25)13-11-12(19)5-6-14(13)20/h3-6,8,11H,2,7,9-10H2,1H3,(H,22,25)

InChI Key

KZCOXVOOQLCOAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27544299

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

344.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.131

Distribution Coefficient, logD

3.131

Water Solubility, LogSw

-3.26

Polar Surface Area

45.555

Acid Dissociation Constant (pKa)

11.43

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

M477-0453 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M477-0453 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M477-0453?
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What is the minimum amount of M477-0453 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M477-0453
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M477-0453
  • 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 M477-0453 available by request