C852-0243 Screening compound: N-(3-chloro-4-methoxyphenyl)-2-(N-methyl2-methyl-1,3-benzothiazole-6-sulfonamido)acetamide

C852-0243 Screening compound: N-(3-chloro-4-methoxyphenyl)-2-(N-methyl2-methyl-1,3-benzothiazole-6-sulfonamido)acetamide
C852-0243 Screening compound: N-(3-chloro-4-methoxyphenyl)-2-(N-methyl2-methyl-1,3-benzothiazole-6-sulfonamido)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C852-0243
N-(3-chloro-4-methoxyphenyl)-2-(N-methyl2-methyl-1,3-benzothiazole-6-sulfonamido)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

C852-0243

Molecular Formula

C18H18ClN3O4S2 (C18 H18 ClN3 O4 S2)

Compound Name

N-(3-chloro-4-methoxyphenyl)-2-(N-methyl2-methyl-1,3-benzothiazole-6-sulfonamido)acetamide

IUPAC name

N-(3-chloro-4-methoxyphenyl)-2-(N-methyl2-methyl-13-benzothiazole-6-sulfonamido)acetamide

SMILES

Cc1nc(ccc(S(N(C)CC(Nc(cc2)cc(Cl)c2OC)=O)(=O)=O)c2)c2s1

InChI

InChI=1S/C18H18ClN3O4S2/c1-11-20-15-6-5-13(9-17(15)27-11)28(24,25)22(2)10-18(23)21-12-4-7-16(26-3)14(19)8-12/h4-9H,10H2,1-3H3,(H,21,23)

InChI Key

FYFBYVLYFSONAE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14800648

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.94

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.756

Distribution Coefficient, logD

3.753

Water Solubility, LogSw

-4.10

Polar Surface Area

73.109

Acid Dissociation Constant (pKa)

9.62

Base Dissociation Constant (pKb)

-0.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

C852-0243 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Angiogenesis library (14822 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Human Proteases Annotated Library (2868 compounds)

Anti-HIV1 Library (19540 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C852-0243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C852-0243?
Check Price and Availability of C852-0243, 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 C852-0243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C852-0243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C852-0243
  • 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 C852-0243 available by request