G842-1450 Screening compound: 2-oxo-N-(1,3-thiazol-2-yl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide

G842-1450 Screening compound: 2-oxo-N-(1,3-thiazol-2-yl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide
G842-1450 Screening compound: 2-oxo-N-(1,3-thiazol-2-yl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G842-1450
2-oxo-N-(1,3-thiazol-2-yl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide

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

G842-1450

Molecular Formula

C17H12F3N3O2S (C17 H12 F3 N3 O2 S)

Compound Name

2-oxo-N-(1,3-thiazol-2-yl)-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2-dihydropyridine-3-carboxamide

IUPAC name

2-oxo-N-(13-thiazol-2-yl)-1-{[4-(trifluoromethyl)phenyl]methyl}-12-dihydropyridine-3-carboxamide

SMILES

O=C(C1=CC=CN(Cc2ccc(C(F)(F)F)cc2)C1=O)Nc1nccs1

InChI

InChI=1S/C17H12F3N3O2S/c18-17(19,20)12-5-3-11(4-6-12)10-23-8-1-2-13(15(23)25)14(24)22-16-21-7-9-26-16/h1-9H,10H2,(H,21,22,24)

InChI Key

AXUBPJPPRDMNBE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00232684

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

2.983

Distribution Coefficient, logD

1.685

Water Solubility, LogSw

-3.41

Polar Surface Area

49.522

Acid Dissociation Constant (pKa)

6.12

Base Dissociation Constant (pKb)

-1.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

G842-1450 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G842-1450 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G842-1450?
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What is the minimum amount of G842-1450 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G842-1450
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G842-1450
  • 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 G842-1450 available by request