8008-5726 Screening compound: 3-methoxy-N~1~-[5-(2-pyridyl)-4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide

8008-5726 Screening compound: 3-methoxy-N~1~-[5-(2-pyridyl)-4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide
8008-5726 Screening compound: 3-methoxy-N~1~-[5-(2-pyridyl)-4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-5726
3-methoxy-N~1~-[5-(2-pyridyl)-4-(trifluoromethyl)-1,3-thiazol-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

8008-5726

Molecular Formula

C17H12F3N3O2S (C17 H12 F3 N3 O2 S)

Compound Name

3-methoxy-N~1~-[5-(2-pyridyl)-4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide

IUPAC name

3-methoxy-N-[5-(pyridin-2-yl)-4-(trifluoromethyl)-13-thiazol-2-yl]benzamide

SMILES

COc1cccc(C(Nc2nc(C(F)(F)F)c(-c3ncccc3)s2)=O)c1

InChI

InChI=1S/C17H12F3N3O2S/c1-25-11-6-4-5-10(9-11)15(24)23-16-22-14(17(18,19)20)13(26-16)12-7-2-3-8-21-12/h2-9H,1H3,(H,22,23,24)

InChI Key

AFLCWSQCZMRMQE-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.113

Distribution Coefficient, logD

3.321

Water Solubility, LogSw

-4.43

Polar Surface Area

50.467

Acid Dissociation Constant (pKa)

6.68

Base Dissociation Constant (pKb)

2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.76

8008-5726 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anticancer Library (62698 compounds)

Proline Kinase Library (2105 compounds)

New Agro Library (44492 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8008-5726 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-5726?
Check Price and Availability of 8008-5726, 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 8008-5726 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-5726
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-5726
  • 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 8008-5726 available by request