C614-0954 Screening compound: N-BUTYL-3-[3-(4-METHOXYBENZYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]PROPANAMIDE

C614-0954 Screening compound: N-BUTYL-3-[3-(4-METHOXYBENZYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]PROPANAMIDE
C614-0954 Screening compound: N-BUTYL-3-[3-(4-METHOXYBENZYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]PROPANAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C614-0954
N-BUTYL-3-[3-(4-METHOXYBENZYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]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

C614-0954

Molecular Formula

C21H26N4O2 (C21 H26 N4 O2)

Compound Name

N-BUTYL-3-[3-(4-METHOXYBENZYL)-3H-IMIDAZO[4,5-B]PYRIDIN-2-YL]PROPANAMIDE

IUPAC name

n/a

SMILES

CCCCNC(CCc(n1Cc(cc2)ccc2OC)nc2c1nccc2)=O

InChI

InChI=1S/C21H26N4O2/c1-3-4-13-22-20(26)12-11-19-24-18-6-5-14-23-21(18)25(19)15-16-7-9-17(27-2)10-8-16/h5-10,14H,3-4,11-13,15H2,1-2H3,(H,22,26)

InChI Key

NZRPZQXLWXPZTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14776376

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.957

Distribution Coefficient, logD

2.957

Water Solubility, LogSw

-3.13

Polar Surface Area

52.907

Acid Dissociation Constant (pKa)

14.72

Base Dissociation Constant (pKb)

4.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

C614-0954 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epigenetics Focused Set (26518 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
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 C614-0954 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C614-0954?
Check Price and Availability of C614-0954, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C614-0954 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C614-0954
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C614-0954
  • 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 C614-0954 available by request