C488-1151 Screening compound: 4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-5-methylimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol

C488-1151 Screening compound: 4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-5-methylimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol
C488-1151 Screening compound: 4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-5-methylimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound C488-1151
4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-5-methylimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol

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

C488-1151

Molecular Formula

C23H21N3O4 (C23 H21 N3 O4)

Compound Name

4-{3-[(2,3-dihydro-1,4-benzodioxin-6-yl)amino]-5-methylimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol

IUPAC name

4-{3-[(23-dihydro-14-benzodioxin-6-yl)amino]-5-methylimidazo[12-a]pyridin-2-yl}-2-methoxyphenol

SMILES

Cc1cccc2nc(-c(cc3)cc(OC)c3O)c(Nc(cc3)cc4c3OCCO4)n12

InChI

InChI=1S/C23H21N3O4/c1-14-4-3-5-21-25-22(15-6-8-17(27)19(12-15)28-2)23(26(14)21)24-16-7-9-18-20(13-16)30-11-10-29-18/h3-9,12-13,24,27H,10-11H2,1-2H3

InChI Key

ITOJSSZNFNNLGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08682482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

403.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.174

Distribution Coefficient, logD

2.864

Water Solubility, LogSw

-3.02

Polar Surface Area

57.325

Acid Dissociation Constant (pKa)

8.99

Base Dissociation Constant (pKb)

7.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

C488-1151 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antimitotic Tubulin Library (17355 compounds)

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

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C488-1151 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C488-1151?
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What is the minimum amount of C488-1151 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C488-1151
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C488-1151
  • 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 C488-1151 available by request