C735-0271 Screening compound: 1-(furan-2-carbonyl)-4-{8-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperazine

C735-0271 Screening compound: 1-(furan-2-carbonyl)-4-{8-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperazine
C735-0271 Screening compound: 1-(furan-2-carbonyl)-4-{8-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound C735-0271
1-(furan-2-carbonyl)-4-{8-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperazine

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

C735-0271

Molecular Formula

C19H18N6O2 (C19 H18 N6 O2)

Compound Name

1-(furan-2-carbonyl)-4-{8-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperazine

IUPAC name

1-(furan-2-carbonyl)-4-{8-methyl-[124]triazolo[43-a]quinoxalin-4-yl}piperazine

SMILES

Cc(cc1)cc(n2c3nnc2)c1nc3N(CC1)CCN1C(c1ccco1)=O

InChI

InChI=1S/C19H18N6O2/c1-13-4-5-14-15(11-13)25-12-20-22-18(25)17(21-14)23-6-8-24(9-7-23)19(26)16-3-2-10-27-16/h2-5,10-12H,6-9H2,1H3

InChI Key

PAVKYTUEZOBQPC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14789831

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.137

Distribution Coefficient, logD

2.101

Water Solubility, LogSw

-2.49

Polar Surface Area

58.946

Acid Dissociation Constant (pKa)

23.99

Base Dissociation Constant (pKb)

6.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

C735-0271 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with C735-0271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C735-0271?
Check Price and Availability of C735-0271, 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 C735-0271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C735-0271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C735-0271
  • 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 C735-0271 available by request