3236-0273 Screening compound: 3-chloro-N~2~-(3-chloro-4-methoxyphenyl)-6-methyl-1-benzothiophene-2-carboxamide

3236-0273 Screening compound: 3-chloro-N~2~-(3-chloro-4-methoxyphenyl)-6-methyl-1-benzothiophene-2-carboxamide
3236-0273 Screening compound: 3-chloro-N~2~-(3-chloro-4-methoxyphenyl)-6-methyl-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3236-0273
3-chloro-N~2~-(3-chloro-4-methoxyphenyl)-6-methyl-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

3236-0273

Molecular Formula

C17H13Cl2NO2S (C17 H13 Cl2 NO2 S)

Compound Name

3-chloro-N~2~-(3-chloro-4-methoxyphenyl)-6-methyl-1-benzothiophene-2-carboxamide

IUPAC name

3-chloro-N-(3-chloro-4-methoxyphenyl)-6-methyl-1-benzothiophene-2-carboxamide

SMILES

Cc(cc1)cc2c1c(Cl)c(C(Nc(cc1)cc(Cl)c1OC)=O)s2

InChI

InChI=1S/C17H13Cl2NO2S/c1-9-3-5-11-14(7-9)23-16(15(11)19)17(21)20-10-4-6-13(22-2)12(18)8-10/h3-8H,1-2H3,(H,20,21)

InChI Key

KFCNRESZSQCZPP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02086860

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.722

Distribution Coefficient, logD

5.704

Water Solubility, LogSw

-6.14

Polar Surface Area

31.707

Acid Dissociation Constant (pKa)

8.77

Base Dissociation Constant (pKb)

-0.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.76

3236-0273 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 3236-0273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3236-0273?
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What is the minimum amount of 3236-0273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3236-0273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3236-0273
  • 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 3236-0273 available by request