K832-3512 Screening compound: 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

K832-3512 Screening compound: 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine
K832-3512 Screening compound: 5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound K832-3512
5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

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

K832-3512

Molecular Formula

C17H11BrClFN4 (C17 H11 BrClFN4)

Compound Name

5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

IUPAC name

5-(4-bromophenyl)-7-(2-chloro-6-fluorophenyl)-4H7H-[124]triazolo[15-a]pyrimidine

SMILES

Fc1cccc(Cl)c1C1n2ncnc2NC(c(cc2)ccc2Br)=C1

InChI

InChI=1S/C17H11BrClFN4/c18-11-6-4-10(5-7-11)14-8-15(24-17(23-14)21-9-22-24)16-12(19)2-1-3-13(16)20/h1-9,15H,(H,21,22,23)/t15-/m1/s1

InChI Key

JASUPOUQOUJFDT-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD03675349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.66

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.878

Distribution Coefficient, logD

4.874

Water Solubility, LogSw

-5.29

Polar Surface Area

38.600

Acid Dissociation Constant (pKa)

9.40

Base Dissociation Constant (pKb)

-1.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

5.90

K832-3512 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with K832-3512 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K832-3512?
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What is the minimum amount of K832-3512 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K832-3512
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K832-3512
  • 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 K832-3512 available by request