D323-0004 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-methylbenzamide

D323-0004 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-methylbenzamide
D323-0004 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D323-0004
N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-methylbenzamide

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

D323-0004

Molecular Formula

C16H12BrN3OS (C16 H12 BrN3 OS)

Compound Name

N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-methylbenzamide

IUPAC name

N-[3-(4-bromophenyl)-124-thiadiazol-5-yl]-2-methylbenzamide

SMILES

Cc(cccc1)c1C(Nc1nc(-c(cc2)ccc2Br)ns1)=O

InChI

InChI=1S/C16H12BrN3OS/c1-10-4-2-3-5-13(10)15(21)19-16-18-14(20-22-16)11-6-8-12(17)9-7-11/h2-9H,1H3,(H,18,19,20,21)

InChI Key

ZAMUXFVCTSTQGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08550098

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.084

Distribution Coefficient, logD

5.066

Water Solubility, LogSw

-4.84

Polar Surface Area

43.917

Acid Dissociation Constant (pKa)

8.77

Base Dissociation Constant (pKb)

-3.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

D323-0004 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

CNS targets activity set (6557 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR
  • Kinases

References: we are preparing a list of scientific research reports with D323-0004 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D323-0004?
Check Price and Availability of D323-0004, 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 D323-0004 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D323-0004
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D323-0004
  • 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 D323-0004 available by request