K832-3711 Screening compound: 2-bromo-4-[2-chloro-7-(4-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]phenyl methyl ether

K832-3711 Screening compound: 2-bromo-4-[2-chloro-7-(4-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]phenyl methyl ether
K832-3711 Screening compound: 2-bromo-4-[2-chloro-7-(4-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]phenyl methyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound K832-3711
2-bromo-4-[2-chloro-7-(4-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]phenyl methyl ether

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

K832-3711

Molecular Formula

C26H20BrClN4O2 (C26 H20 BrClN4 O2)

Compound Name

2-bromo-4-[2-chloro-7-(4-methylphenyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidin-6-yl]phenyl methyl ether

IUPAC name

9-(3-bromo-4-methoxyphenyl)-4-chloro-11-(4-methylphenyl)-8-oxa-12131517-tetraazatetracyclo[8.7.0.0^{27}.0^{1216}]heptadeca-1(10)2(7)351315-hexaene

SMILES

Cc1ccc(C2n3ncnc3NC3=C2C(c(cc2)cc(Br)c2OC)Oc(cc2)c3cc2Cl)cc1

InChI

InChI=1S/C26H20BrClN4O2/c1-14-3-5-15(6-4-14)24-22-23(31-26-29-13-30-32(24)26)18-12-17(28)8-10-20(18)34-25(22)16-7-9-21(33-2)19(27)11-16/h3-13,24-25H,1-2H3,(H,29,30,31)

InChI Key

JXZOXUKSCOBHBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05719119

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

535.83

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.383

Distribution Coefficient, logD

6.383

Water Solubility, LogSw

-6.53

Polar Surface Area

53.238

Acid Dissociation Constant (pKa)

10.08

Base Dissociation Constant (pKb)

-1.79

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

15.40

K832-3711 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with K832-3711 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K832-3711?
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What is the minimum amount of K832-3711 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K832-3711
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K832-3711
  • 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 K832-3711 available by request