C481-0744 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonamido)-N-(3-chloro-4-methylphenyl)-2-phenylacetamide

C481-0744 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonamido)-N-(3-chloro-4-methylphenyl)-2-phenylacetamide
C481-0744 Screening compound: 2-(2,1,3-benzothiadiazole-4-sulfonamido)-N-(3-chloro-4-methylphenyl)-2-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C481-0744
2-(2,1,3-benzothiadiazole-4-sulfonamido)-N-(3-chloro-4-methylphenyl)-2-phenylacetamide

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

C481-0744

Molecular Formula

C21H17ClN4O3S2 (C21 H17 ClN4 O3 S2)

Compound Name

2-(2,1,3-benzothiadiazole-4-sulfonamido)-N-(3-chloro-4-methylphenyl)-2-phenylacetamide

IUPAC name

2-(213-benzothiadiazole-4-sulfonamido)-N-(3-chloro-4-methylphenyl)-2-phenylacetamide

SMILES

Cc(ccc(NC(C(c1ccccc1)NS(c1cccc2nsnc12)(=O)=O)=O)c1)c1Cl

InChI

InChI=1S/C21H17ClN4O3S2/c1-13-10-11-15(12-16(13)22)23-21(27)19(14-6-3-2-4-7-14)26-31(28,29)18-9-5-8-17-20(18)25-30-24-17/h2-12,19,26H,1H3,(H,23,27)/t19-/m1/s1

InChI Key

HVNYYCJGUWSZPA-LJQANCHMSA-N

MDL Number (MFCD)

MFCD14760588

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.98

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.751

Distribution Coefficient, logD

4.659

Water Solubility, LogSw

-4.96

Polar Surface Area

85.606

Acid Dissociation Constant (pKa)

8.03

Base Dissociation Constant (pKb)

-0.75

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

9.50

C481-0744 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C481-0744 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C481-0744?
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What is the minimum amount of C481-0744 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C481-0744
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C481-0744
  • 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 C481-0744 available by request