C259-0194 Screening compound: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(N-methylthiophene-2-sulfonamido)acetamide

C259-0194 Screening compound: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(N-methylthiophene-2-sulfonamido)acetamide
C259-0194 Screening compound: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(N-methylthiophene-2-sulfonamido)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C259-0194
N-(4-methyl-1,3-benzothiazol-2-yl)-2-(N-methylthiophene-2-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

C259-0194

Molecular Formula

C15H15N3O3S3 (C15 H15 N3 O3 S3)

Compound Name

N-(4-methyl-1,3-benzothiazol-2-yl)-2-(N-methylthiophene-2-sulfonamido)acetamide

IUPAC name

N-(4-methyl-13-benzothiazol-2-yl)-2-(N-methylthiophene-2-sulfonamido)acetamide

SMILES

Cc1cccc2c1nc(NC(CN(C)S(c1cccs1)(=O)=O)=O)s2

InChI

InChI=1S/C15H15N3O3S3/c1-10-5-3-6-11-14(10)17-15(23-11)16-12(19)9-18(2)24(20,21)13-7-4-8-22-13/h3-8H,9H2,1-2H3,(H,16,17,19)

InChI Key

OHLVECCCMAOXAY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10736214

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.350

Distribution Coefficient, logD

3.349

Water Solubility, LogSw

-3.47

Polar Surface Area

67.502

Acid Dissociation Constant (pKa)

10.54

Base Dissociation Constant (pKb)

0.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C259-0194 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C259-0194 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C259-0194?
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What is the minimum amount of C259-0194 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C259-0194
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C259-0194
  • 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 C259-0194 available by request