8016-2493 Screening compound: 3-chloro-4-ethoxy-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide

8016-2493 Screening compound: 3-chloro-4-ethoxy-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide
8016-2493 Screening compound: 3-chloro-4-ethoxy-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-2493
3-chloro-4-ethoxy-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide

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

8016-2493

Molecular Formula

C16H12ClFN2O2S (C16 H12 ClFN2 O2 S)

Compound Name

3-chloro-4-ethoxy-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide

IUPAC name

3-chloro-4-ethoxy-N-(6-fluoro-13-benzothiazol-2-yl)benzamide

SMILES

CCOc(ccc(C(Nc1nc(ccc(F)c2)c2s1)=O)c1)c1Cl

InChI

InChI=1S/C16H12ClFN2O2S/c1-2-22-13-6-3-9(7-11(13)17)15(21)20-16-19-12-5-4-10(18)8-14(12)23-16/h3-8H,2H2,1H3,(H,19,20,21)

InChI Key

FFEYJNCMSFFGAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04277376

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.8

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.580

Distribution Coefficient, logD

4.574

Water Solubility, LogSw

-4.74

Polar Surface Area

40.301

Acid Dissociation Constant (pKa)

9.23

Base Dissociation Constant (pKb)

-1.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

8016-2493 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases

References: we are preparing a list of scientific research reports with 8016-2493 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-2493?
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What is the minimum amount of 8016-2493 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-2493
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-2493
  • 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 8016-2493 available by request