D423-0118 Screening compound: 6-(3-bromo-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

D423-0118 Screening compound: 6-(3-bromo-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
D423-0118 Screening compound: 6-(3-bromo-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D423-0118
6-(3-bromo-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

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

D423-0118

Molecular Formula

C11H9BrN4OS (C11 H9 BrN4 OS)

Compound Name

6-(3-bromo-4-methoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

IUPAC name

6-(3-bromo-4-methoxyphenyl)-7H-[124]triazolo[34-b][134]thiadiazine

SMILES

COc(ccc(C(CS1)=Nn2c1nnc2)c1)c1Br

InChI

InChI=1S/C11H9BrN4OS/c1-17-10-3-2-7(4-8(10)12)9-5-18-11-14-13-6-16(11)15-9/h2-4,6H,5H2,1H3

InChI Key

FRMZKJCQJMRBEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14828146

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.19

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.506

Distribution Coefficient, logD

2.488

Water Solubility, LogSw

-2.63

Polar Surface Area

42.583

Acid Dissociation Constant (pKa)

19.22

Base Dissociation Constant (pKb)

6.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

D423-0118 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D423-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D423-0118?
Check Price and Availability of D423-0118, 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 D423-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D423-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D423-0118
  • 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 D423-0118 available by request