C669-2774 Screening compound: N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-methylquinoxalin-2-yl}-4-chlorobenzene-1-sulfonamide

C669-2774 Screening compound: N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-methylquinoxalin-2-yl}-4-chlorobenzene-1-sulfonamide
C669-2774 Screening compound: N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-methylquinoxalin-2-yl}-4-chlorobenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C669-2774
N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-methylquinoxalin-2-yl}-4-chlorobenzene-1-sulfonamide

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

C669-2774

Molecular Formula

C22H17ClN4O4S (C22 H17 ClN4 O4 S)

Compound Name

N-{3-[(2H-1,3-benzodioxol-5-yl)amino]-6-methylquinoxalin-2-yl}-4-chlorobenzene-1-sulfonamide

IUPAC name

N-{3-[(2H-13-benzodioxol-5-yl)amino]-6-methylquinoxalin-2-yl}-4-chlorobenzene-1-sulfonamide

SMILES

Cc(cc1nc2Nc(cc3)cc4c3OCO4)ccc1nc2NS(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C22H17ClN4O4S/c1-13-2-8-17-18(10-13)26-21(24-15-5-9-19-20(11-15)31-12-30-19)22(25-17)27-32(28,29)16-6-3-14(23)4-7-16/h2-11H,12H2,1H3,(H,24,26)(H,25,27)

InChI Key

BYCROJVFLDYPAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07435737

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

468.92

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.486

Distribution Coefficient, logD

3.941

Water Solubility, LogSw

-5.95

Polar Surface Area

85.128

Acid Dissociation Constant (pKa)

5.87

Base Dissociation Constant (pKb)

3.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

C669-2774 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

C-Met Library (15277 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C669-2774 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C669-2774?
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What is the minimum amount of C669-2774 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C669-2774
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C669-2774
  • 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 C669-2774 available by request