G843-1066 Screening compound: N-(4-ethoxyphenyl)-1-[(2-fluorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxamide

G843-1066 Screening compound: N-(4-ethoxyphenyl)-1-[(2-fluorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxamide
G843-1066 Screening compound: N-(4-ethoxyphenyl)-1-[(2-fluorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G843-1066
N-(4-ethoxyphenyl)-1-[(2-fluorophenyl)methyl]-6-oxo-1,6-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

G843-1066

Molecular Formula

C21H19FN2O3 (C21 H19 FN2 O3)

Compound Name

N-(4-ethoxyphenyl)-1-[(2-fluorophenyl)methyl]-6-oxo-1,6-dihydropyridine-3-carboxamide

IUPAC name

N-(4-ethoxyphenyl)-1-[(2-fluorophenyl)methyl]-6-oxo-16-dihydropyridine-3-carboxamide

SMILES

CCOc(cc1)ccc1NC(C(C=C1)=CN(Cc(cccc2)c2F)C1=O)=O

InChI

InChI=1S/C21H19FN2O3/c1-2-27-18-10-8-17(9-11-18)23-21(26)16-7-12-20(25)24(14-16)13-15-5-3-4-6-19(15)22/h3-12,14H,2,13H2,1H3,(H,23,26)

InChI Key

GGUAYPXOUNQPAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09247770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.373

Distribution Coefficient, logD

3.360

Water Solubility, LogSw

-3.42

Polar Surface Area

46.964

Acid Dissociation Constant (pKa)

8.93

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

G843-1066 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G843-1066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G843-1066?
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What is the minimum amount of G843-1066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G843-1066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G843-1066
  • 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 G843-1066 available by request