C614-0594 Screening compound: 3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}-N-[(pyridin-2-yl)methyl]propanamide

C614-0594 Screening compound: 3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}-N-[(pyridin-2-yl)methyl]propanamide
C614-0594 Screening compound: 3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}-N-[(pyridin-2-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-0594
3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}-N-[(pyridin-2-yl)methyl]propanamide

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

C614-0594

Molecular Formula

C23H23N5O2 (C23 H23 N5 O2)

Compound Name

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

IUPAC name

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

SMILES

COc1ccc(Cn2c(nccc3)c3nc2CCC(NCc2ncccc2)=O)cc1

InChI

InChI=1S/C23H23N5O2/c1-30-19-9-7-17(8-10-19)16-28-21(27-20-6-4-14-25-23(20)28)11-12-22(29)26-15-18-5-2-3-13-24-18/h2-10,13-14H,11-12,15-16H2,1H3,(H,26,29)

InChI Key

HUEMGLGCENSPIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.393

Distribution Coefficient, logD

2.393

Water Solubility, LogSw

-2.56

Polar Surface Area

62.337

Acid Dissociation Constant (pKa)

12.67

Base Dissociation Constant (pKb)

4.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

C614-0594 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C614-0594 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-0594?
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What is the minimum amount of C614-0594 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-0594
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-0594
  • 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 C614-0594 available by request