D468-1937 Screening compound: N-(2,1,3-benzothiadiazol-5-yl)-2-(2-chlorophenoxy)acetamide

D468-1937 Screening compound: N-(2,1,3-benzothiadiazol-5-yl)-2-(2-chlorophenoxy)acetamide
D468-1937 Screening compound: N-(2,1,3-benzothiadiazol-5-yl)-2-(2-chlorophenoxy)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D468-1937
N-(2,1,3-benzothiadiazol-5-yl)-2-(2-chlorophenoxy)acetamide

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

D468-1937

Molecular Formula

C14H10ClN3O2S (C14 H10 ClN3 O2 S)

Compound Name

N-(2,1,3-benzothiadiazol-5-yl)-2-(2-chlorophenoxy)acetamide

IUPAC name

N-(213-benzothiadiazol-5-yl)-2-(2-chlorophenoxy)acetamide

SMILES

O=C(COc(cccc1)c1Cl)Nc1cc2nsnc2cc1

InChI

InChI=1S/C14H10ClN3O2S/c15-10-3-1-2-4-13(10)20-8-14(19)16-9-5-6-11-12(7-9)18-21-17-11/h1-7H,8H2,(H,16,19)

InChI Key

VUSHGJZFFKLDAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12919574

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.77

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.726

Distribution Coefficient, logD

3.725

Water Solubility, LogSw

-4.12

Polar Surface Area

50.884

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

-0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

D468-1937 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with D468-1937 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D468-1937?
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What is the minimum amount of D468-1937 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D468-1937
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D468-1937
  • 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 D468-1937 available by request