C301-8683 Screening compound: 2-(thiophen-2-yl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-ol

C301-8683 Screening compound: 2-(thiophen-2-yl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-ol
C301-8683 Screening compound: 2-(thiophen-2-yl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-8683
2-(thiophen-2-yl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-ol

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

C301-8683

Molecular Formula

C13H12N4OS (C13 H12 N4 OS)

Compound Name

2-(thiophen-2-yl)-5H,6H,7H,8H-[1,2,4]triazolo[3,2-b]quinazolin-9-ol

IUPAC name

2-(thiophen-2-yl)-5H6H7H8H-[124]triazolo[32-b]quinazolin-9-ol

SMILES

Oc1c(CCCC2)c2nc2nc(-c3cccs3)nn12

InChI

InChI=1S/C13H12N4OS/c18-12-8-4-1-2-5-9(8)14-13-15-11(16-17(12)13)10-6-3-7-19-10/h3,6-7,18H,1-2,4-5H2

InChI Key

MOMLNQNQUUQLFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14745596

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

272.33

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.654

Distribution Coefficient, logD

1.011

Water Solubility, LogSw

-2.42

Polar Surface Area

51.595

Acid Dissociation Constant (pKa)

5.77

Base Dissociation Constant (pKb)

5.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

C301-8683 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C301-8683 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-8683?
Check Price and Availability of C301-8683, 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 C301-8683 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-8683
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-8683
  • 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 C301-8683 available by request