7101-0213 Screening compound: 6-bromo-2-phenyl-4-{3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}quinoline

7101-0213 Screening compound: 6-bromo-2-phenyl-4-{3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}quinoline
7101-0213 Screening compound: 6-bromo-2-phenyl-4-{3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 7101-0213
6-bromo-2-phenyl-4-{3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}quinoline

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

7101-0213

Molecular Formula

C24H14BrN5S (C24 H14 BrN5 S)

Compound Name

6-bromo-2-phenyl-4-{3-phenyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}quinoline

IUPAC name

6-bromo-2-phenyl-4-{3-phenyl-[124]triazolo[34-b][134]thiadiazol-6-yl}quinoline

SMILES

Brc(ccc1nc(-c2ccccc2)c2)cc1c2-c(s1)nn2c1nnc2-c1ccccc1

InChI

InChI=1S/C24H14BrN5S/c25-17-11-12-20-18(13-17)19(14-21(26-20)15-7-3-1-4-8-15)23-29-30-22(27-28-24(30)31-23)16-9-5-2-6-10-16/h1-14H

InChI Key

VYEDZDDTNMYDMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06438256

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

484.38

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.847

Distribution Coefficient, logD

6.846

Water Solubility, LogSw

-6.73

Polar Surface Area

41.781

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

7101-0213 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
  • Agro

References: we are preparing a list of scientific research reports with 7101-0213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7101-0213?
Check Price and Availability of 7101-0213, 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 7101-0213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7101-0213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7101-0213
  • 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 7101-0213 available by request