K832-3731 Screening compound: 6-(3-fluorophenyl)-2-methyl-7-phenyl-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine

K832-3731 Screening compound: 6-(3-fluorophenyl)-2-methyl-7-phenyl-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
K832-3731 Screening compound: 6-(3-fluorophenyl)-2-methyl-7-phenyl-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound K832-3731
6-(3-fluorophenyl)-2-methyl-7-phenyl-7,12-dihydro-6H-chromeno[4,3-d][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

K832-3731

Molecular Formula

C25H19FN4O (C25 H19 FN4 O)

Compound Name

6-(3-fluorophenyl)-2-methyl-7-phenyl-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine

IUPAC name

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

SMILES

Cc(cc1)cc(C2=C3C(c4ccccc4)n4ncnc4N2)c1OC3c1cccc(F)c1

InChI

InChI=1S/C25H19FN4O/c1-15-10-11-20-19(12-15)22-21(24(31-20)17-8-5-9-18(26)13-17)23(16-6-3-2-4-7-16)30-25(29-22)27-14-28-30/h2-14,23-24H,1H3,(H,27,28,29)

InChI Key

ADWXJAPAWCDCFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05028357

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.357

Distribution Coefficient, logD

5.357

Water Solubility, LogSw

-5.58

Polar Surface Area

45.607

Acid Dissociation Constant (pKa)

10.44

Base Dissociation Constant (pKb)

-1.79

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

12.00

K832-3731 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Others
  • Kinases

References: we are preparing a list of scientific research reports with K832-3731 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K832-3731?
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What is the minimum amount of K832-3731 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K832-3731
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K832-3731
  • 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 K832-3731 available by request