F111-0757 Screening compound: 2-(3-methylphenoxy)-N-{2-[2-(2-phenylethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}acetamide

F111-0757 Screening compound: 2-(3-methylphenoxy)-N-{2-[2-(2-phenylethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}acetamide
F111-0757 Screening compound: 2-(3-methylphenoxy)-N-{2-[2-(2-phenylethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F111-0757
2-(3-methylphenoxy)-N-{2-[2-(2-phenylethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}acetamide

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

F111-0757

Molecular Formula

C25H26N4O2 (C25 H26 N4 O2)

Compound Name

2-(3-methylphenoxy)-N-{2-[2-(2-phenylethyl)-3H-imidazo[4,5-b]pyridin-3-yl]ethyl}acetamide

IUPAC name

2-(3-methylphenoxy)-N-{2-[2-(2-phenylethyl)-3H-imidazo[45-b]pyridin-3-yl]ethyl}acetamide

SMILES

Cc1cccc(OCC(NCCn2c3ncccc3nc2CCc2ccccc2)=O)c1

InChI

InChI=1S/C25H26N4O2/c1-19-7-5-10-21(17-19)31-18-24(30)26-15-16-29-23(13-12-20-8-3-2-4-9-20)28-22-11-6-14-27-25(22)29/h2-11,14,17H,12-13,15-16,18H2,1H3,(H,26,30)

InChI Key

BARRUMVMOWLKSA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27101948

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.51

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

4.127

Distribution Coefficient, logD

4.127

Water Solubility, LogSw

-4.27

Polar Surface Area

52.569

Acid Dissociation Constant (pKa)

14.66

Base Dissociation Constant (pKb)

4.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F111-0757 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F111-0757 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F111-0757?
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What is the minimum amount of F111-0757 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F111-0757
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F111-0757
  • 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 F111-0757 available by request