F872-0488 Screening compound: 3-(2-{3-cyclopentyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)-1-(2,5-dimethylphenyl)urea

F872-0488 Screening compound: 3-(2-{3-cyclopentyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)-1-(2,5-dimethylphenyl)urea
F872-0488 Screening compound: 3-(2-{3-cyclopentyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)-1-(2,5-dimethylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound F872-0488
3-(2-{3-cyclopentyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)-1-(2,5-dimethylphenyl)urea

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

F872-0488

Molecular Formula

C22H27N5O (C22 H27 N5 O)

Compound Name

3-(2-{3-cyclopentyl-3H-imidazo[4,5-b]pyridin-2-yl}ethyl)-1-(2,5-dimethylphenyl)urea

IUPAC name

3-(2-{3-cyclopentyl-3H-imidazo[45-b]pyridin-2-yl}ethyl)-1-(25-dimethylphenyl)urea

SMILES

Cc1cc(NC(NCCc(n2C3CCCC3)nc3c2nccc3)=O)c(C)cc1

InChI

InChI=1S/C22H27N5O/c1-15-9-10-16(2)19(14-15)26-22(28)24-13-11-20-25-18-8-5-12-23-21(18)27(20)17-6-3-4-7-17/h5,8-10,12,14,17H,3-4,6-7,11,13H2,1-2H3,(H2,24,26,28)

InChI Key

ZAEOIFCVBSQZQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14969596

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.238

Distribution Coefficient, logD

3.238

Water Solubility, LogSw

-3.15

Polar Surface Area

54.761

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

2.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

F872-0488 in Drug Discovery

Included in Screening Libraries

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F872-0488 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F872-0488?
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What is the minimum amount of F872-0488 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F872-0488
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F872-0488
  • 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 F872-0488 available by request