D323-0089 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-ethoxybenzamide

D323-0089 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-ethoxybenzamide
D323-0089 Screening compound: N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-ethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D323-0089
N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-2-ethoxybenzamide

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

D323-0089

Molecular Formula

C17H14BrN3O2S (C17 H14 BrN3 O2 S)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C17H14BrN3O2S/c1-2-23-14-6-4-3-5-13(14)16(22)20-17-19-15(21-24-17)11-7-9-12(18)10-8-11/h3-10H,2H2,1H3,(H,19,20,21,22)

InChI Key

BFCYSBIACIWGFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08545152

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.144

Distribution Coefficient, logD

5.052

Water Solubility, LogSw

-4.94

Polar Surface Area

51.127

Acid Dissociation Constant (pKa)

8.03

Base Dissociation Constant (pKb)

-4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

D323-0089 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • GPCR
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with D323-0089 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D323-0089?
Check Price and Availability of D323-0089, 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 D323-0089 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D323-0089
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D323-0089
  • 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 D323-0089 available by request