8537-2851 Screening compound: 4-[6-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-N,N-dimethylaniline

8537-2851 Screening compound: 4-[6-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-N,N-dimethylaniline
8537-2851 Screening compound: 4-[6-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-N,N-dimethylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 8537-2851
4-[6-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-N,N-dimethylaniline

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

8537-2851

Molecular Formula

C18H16BrN5S (C18 H16 BrN5 S)

Compound Name

4-[6-(4-bromophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]-N,N-dimethylaniline

IUPAC name

4-[6-(4-bromophenyl)-7H-[124]triazolo[34-b][134]thiadiazin-3-yl]-NN-dimethylaniline

SMILES

CN(C)c(cc1)ccc1-c1nnc2SCC(c(cc3)ccc3Br)=Nn12

InChI

InChI=1S/C18H16BrN5S/c1-23(2)15-9-5-13(6-10-15)17-20-21-18-24(17)22-16(11-25-18)12-3-7-14(19)8-4-12/h3-10H,11H2,1-2H3

InChI Key

LZPYLUHZXPQOAU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08747623

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.33

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

4.919

Distribution Coefficient, logD

4.918

Water Solubility, LogSw

-4.61

Polar Surface Area

36.763

Acid Dissociation Constant (pKa)

19.07

Base Dissociation Constant (pKb)

4.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8537-2851 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8537-2851 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8537-2851?
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What is the minimum amount of 8537-2851 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8537-2851
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8537-2851
  • 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 8537-2851 available by request