G423-0346 Screening compound: 4-[7-(3,4-difluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(4-fluorophenyl)butanamide

G423-0346 Screening compound: 4-[7-(3,4-difluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(4-fluorophenyl)butanamide
G423-0346 Screening compound: 4-[7-(3,4-difluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(4-fluorophenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G423-0346
4-[7-(3,4-difluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(4-fluorophenyl)butanamide

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

G423-0346

Molecular Formula

C21H16F3N5O2 (C21 H16 F3 N5 O2)

Compound Name

4-[7-(3,4-difluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(4-fluorophenyl)butanamide

IUPAC name

4-[7-(34-difluorophenyl)-8-oxo-7H8H-[124]triazolo[43-a]pyrazin-3-yl]-N-(4-fluorophenyl)butanamide

SMILES

O=C(CCCc1nnc2n1C=CN(c(cc1)cc(F)c1F)C2=O)Nc(cc1)ccc1F

InChI

InChI=1S/C21H16F3N5O2/c22-13-4-6-14(7-5-13)25-19(30)3-1-2-18-26-27-20-21(31)28(10-11-29(18)20)15-8-9-16(23)17(24)12-15/h4-12H,1-3H2,(H,25,30)

InChI Key

HZPJGJHISSXDSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27140551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.621

Distribution Coefficient, logD

1.620

Water Solubility, LogSw

-2.14

Polar Surface Area

62.246

Acid Dissociation Constant (pKa)

10.73

Base Dissociation Constant (pKb)

-0.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

G423-0346 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with G423-0346 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G423-0346?
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What is the minimum amount of G423-0346 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G423-0346
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G423-0346
  • 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 G423-0346 available by request