M477-0594 Screening compound: 3-chloro-N-{2-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]ethyl}benzamide

M477-0594 Screening compound: 3-chloro-N-{2-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]ethyl}benzamide
M477-0594 Screening compound: 3-chloro-N-{2-[3-(propan-2-yl)-3H-imidazo[4,5-b]pyridin-2-yl]ethyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M477-0594
3-chloro-N-{2-[3-(propan-2-yl)-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

M477-0594

Molecular Formula

C18H19ClN4O (C18 H19 ClN4 O)

Compound Name

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

IUPAC name

3-chloro-N-{2-[3-(propan-2-yl)-3H-imidazo[45-b]pyridin-2-yl]ethyl}benzamide

SMILES

CC(C)n1c(nccc2)c2nc1CCNC(c1cccc(Cl)c1)=O

InChI

InChI=1S/C18H19ClN4O/c1-12(2)23-16(22-15-7-4-9-20-17(15)23)8-10-21-18(24)13-5-3-6-14(19)11-13/h3-7,9,11-12H,8,10H2,1-2H3,(H,21,24)

InChI Key

IURAMVMJPHFOHD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27544325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.83

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.968

Distribution Coefficient, logD

2.968

Water Solubility, LogSw

-3.64

Polar Surface Area

46.652

Acid Dissociation Constant (pKa)

12.37

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

M477-0594 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 M477-0594 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M477-0594?
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What is the minimum amount of M477-0594 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M477-0594
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M477-0594
  • 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 M477-0594 available by request