4105-0220 Screening compound: N~1~-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(trifluoromethyl)-1-benzenesulfonamide

4105-0220 Screening compound: N~1~-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(trifluoromethyl)-1-benzenesulfonamide
4105-0220 Screening compound: N~1~-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(trifluoromethyl)-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4105-0220
N~1~-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(trifluoromethyl)-1-benzenesulfonamide

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

4105-0220

Molecular Formula

C20H14F3N3O2S (C20 H14 F3 N3 O2 S)

Compound Name

N~1~-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-(trifluoromethyl)-1-benzenesulfonamide

IUPAC name

N-(3-{imidazo[12-a]pyridin-2-yl}phenyl)-3-(trifluoromethyl)benzene-1-sulfonamide

SMILES

O=S(c1cc(C(F)(F)F)ccc1)(Nc1cc(-c2cn(cccc3)c3n2)ccc1)=O

InChI

InChI=1S/C20H14F3N3O2S/c21-20(22,23)15-6-4-8-17(12-15)29(27,28)25-16-7-3-5-14(11-16)18-13-26-10-2-1-9-19(26)24-18/h1-13,25H

InChI Key

YDSUVQIHQGJHLB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02580220

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.866

Distribution Coefficient, logD

4.856

Water Solubility, LogSw

-4.77

Polar Surface Area

50.283

Acid Dissociation Constant (pKa)

9.47

Base Dissociation Constant (pKb)

5.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

4105-0220 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 4105-0220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4105-0220?
Check Price and Availability of 4105-0220, 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 4105-0220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4105-0220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4105-0220
  • 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 4105-0220 available by request