C850-0345 Screening compound: 3-({8-chloro-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzoic acid

C850-0345 Screening compound: 3-({8-chloro-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzoic acid
C850-0345 Screening compound: 3-({8-chloro-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C850-0345
3-({8-chloro-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzoic acid

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

C850-0345

Molecular Formula

C16H10ClN5O2 (C16 H10 ClN5 O2)

Compound Name

3-({8-chloro-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}amino)benzoic acid

IUPAC name

3-({8-chloro-[124]triazolo[43-a]quinoxalin-4-yl}amino)benzoic acid

SMILES

OC(c1cccc(Nc2nc(ccc(Cl)c3)c3n3c2nnc3)c1)=O

InChI

InChI=1S/C16H10ClN5O2/c17-10-4-5-12-13(7-10)22-8-18-21-15(22)14(20-12)19-11-3-1-2-9(6-11)16(23)24/h1-8H,(H,19,20)(H,23,24)

InChI Key

JHONHYNOSXDNDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14800519

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.74

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.566

Distribution Coefficient, logD

0.272

Water Solubility, LogSw

-3.88

Polar Surface Area

68.486

Acid Dissociation Constant (pKa)

4.11

Base Dissociation Constant (pKb)

5.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

C850-0345 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with C850-0345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C850-0345?
Check Price and Availability of C850-0345, 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 C850-0345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C850-0345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C850-0345
  • 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 C850-0345 available by request