F843-0641 Screening compound: N-butyl-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo-1H,2H-[1,2,4]triazolo[4,3-a]quinoxalin-2-yl}acetamide

F843-0641 Screening compound: N-butyl-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo-1H,2H-[1,2,4]triazolo[4,3-a]quinoxalin-2-yl}acetamide
F843-0641 Screening compound: N-butyl-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo-1H,2H-[1,2,4]triazolo[4,3-a]quinoxalin-2-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F843-0641
N-butyl-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo-1H,2H-[1,2,4]triazolo[4,3-a]quinoxalin-2-yl}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

F843-0641

Molecular Formula

C22H23N5O3S (C22 H23 N5 O3 S)

Compound Name

N-butyl-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo-1H,2H-[1,2,4]triazolo[4,3-a]quinoxalin-2-yl}acetamide

IUPAC name

N-butyl-2-{4-[(3-methoxyphenyl)sulfanyl]-1-oxo-1H2H-[124]triazolo[43-a]quinoxalin-2-yl}acetamide

SMILES

CCCCNC(CN(C1=O)N=C2N1c(cccc1)c1N=C2Sc1cc(OC)ccc1)=O

InChI

InChI=1S/C22H23N5O3S/c1-3-4-12-23-19(28)14-26-22(29)27-18-11-6-5-10-17(18)24-21(20(27)25-26)31-16-9-7-8-15(13-16)30-2/h5-11,13H,3-4,12,14H2,1-2H3,(H,23,28)

InChI Key

UJBSEBIHUKKYMP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27199103

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.327

Distribution Coefficient, logD

3.327

Water Solubility, LogSw

-3.73

Polar Surface Area

71.265

Acid Dissociation Constant (pKa)

15.67

Base Dissociation Constant (pKb)

1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

F843-0641 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F843-0641 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F843-0641?
Check Price and Availability of F843-0641, 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 F843-0641 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F843-0641
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F843-0641
  • 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 F843-0641 available by request