J019-0242 Screening compound: N-(4-chloro-2-methylphenyl)-5-(N-methylethanesulfonamido)-1-benzothiophene-2-carboxamide

J019-0242 Screening compound: N-(4-chloro-2-methylphenyl)-5-(N-methylethanesulfonamido)-1-benzothiophene-2-carboxamide
J019-0242 Screening compound: N-(4-chloro-2-methylphenyl)-5-(N-methylethanesulfonamido)-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J019-0242
N-(4-chloro-2-methylphenyl)-5-(N-methylethanesulfonamido)-1-benzothiophene-2-carboxamide

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

J019-0242

Molecular Formula

C19H19ClN2O3S2 (C19 H19 ClN2 O3 S2)

Compound Name

N-(4-chloro-2-methylphenyl)-5-(N-methylethanesulfonamido)-1-benzothiophene-2-carboxamide

IUPAC name

N-(4-chloro-2-methylphenyl)-5-(N-methylethanesulfonamido)-1-benzothiophene-2-carboxamide

SMILES

CCS(N(C)c(cc1)cc2c1sc(C(Nc(cc1)c(C)cc1Cl)=O)c2)(=O)=O

InChI

InChI=1S/C19H19ClN2O3S2/c1-4-27(24,25)22(3)15-6-8-17-13(10-15)11-18(26-17)19(23)21-16-7-5-14(20)9-12(16)2/h5-11H,4H2,1-3H3,(H,21,23)

InChI Key

YREJSNVWEQGAKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27218050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.096

Distribution Coefficient, logD

5.095

Water Solubility, LogSw

-5.24

Polar Surface Area

56.366

Acid Dissociation Constant (pKa)

9.88

Base Dissociation Constant (pKb)

-0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

J019-0242 in Drug Discovery

Included in Screening Libraries

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with J019-0242 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J019-0242?
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What is the minimum amount of J019-0242 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J019-0242
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J019-0242
  • 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 J019-0242 available by request