C850-0636 Screening compound: N-[2-(4-chlorophenyl)ethyl]-[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-amine

C850-0636 Screening compound: N-[2-(4-chlorophenyl)ethyl]-[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-amine
C850-0636 Screening compound: N-[2-(4-chlorophenyl)ethyl]-[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C850-0636
N-[2-(4-chlorophenyl)ethyl]-[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-amine

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

C850-0636

Molecular Formula

C16H13ClN6 (C16 H13 ClN6)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-[1,2,3,4]tetrazolo[1,5-a]quinoxalin-4-amine

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-[1234]tetrazolo[15-a]quinoxalin-4-amine

SMILES

Clc1ccc(CCNc2nc(cccc3)c3n3nnnc23)cc1

InChI

InChI=1S/C16H13ClN6/c17-12-7-5-11(6-8-12)9-10-18-15-16-20-21-22-23(16)14-4-2-1-3-13(14)19-15/h1-8H,9-10H2,(H,18,19)

InChI Key

YDVCJPJYPOGTML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14800552

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.77

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.285

Distribution Coefficient, logD

3.284

Water Solubility, LogSw

-3.69

Polar Surface Area

55.541

Acid Dissociation Constant (pKa)

19.16

Base Dissociation Constant (pKb)

4.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

C850-0636 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C850-0636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C850-0636?
Check Price and Availability of C850-0636, 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 C850-0636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C850-0636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C850-0636
  • 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 C850-0636 available by request