C187-0131 Screening compound: N-(3-ethylphenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide

C187-0131 Screening compound: N-(3-ethylphenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide
C187-0131 Screening compound: N-(3-ethylphenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C187-0131
N-(3-ethylphenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)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

C187-0131

Molecular Formula

C17H16N2O2S (C17 H16 N2 O2 S)

Compound Name

N-(3-ethylphenyl)-2-(2-oxo-2,3-dihydro-1,3-benzothiazol-3-yl)acetamide

IUPAC name

N-(3-ethylphenyl)-2-(2-oxo-23-dihydro-13-benzothiazol-3-yl)acetamide

SMILES

CCc1cccc(NC(CN(c(cccc2)c2S2)C2=O)=O)c1

InChI

InChI=1S/C17H16N2O2S/c1-2-12-6-5-7-13(10-12)18-16(20)11-19-14-8-3-4-9-15(14)22-17(19)21/h3-10H,2,11H2,1H3,(H,18,20)

InChI Key

FFKQKHFUUQVZCP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14724543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.889

Distribution Coefficient, logD

3.889

Water Solubility, LogSw

-3.91

Polar Surface Area

38.961

Acid Dissociation Constant (pKa)

12.98

Base Dissociation Constant (pKb)

1.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

C187-0131 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C187-0131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C187-0131?
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What is the minimum amount of C187-0131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C187-0131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C187-0131
  • 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 C187-0131 available by request