G423-0552 Screening compound: N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide

G423-0552 Screening compound: N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide
G423-0552 Screening compound: N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G423-0552
N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7H,8H-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-3-methylbutanamide

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

G423-0552

Molecular Formula

C22H19ClFN5O2 (C22 H19 ClFN5 O2)

Compound Name

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

IUPAC name

N-(4-chlorophenyl)-4-[7-(3-fluorophenyl)-8-oxo-7H8H-[124]triazolo[43-a]pyrazin-3-yl]-3-methylbutanamide

SMILES

CC(CC(Nc(cc1)ccc1Cl)=O)Cc1nnc2n1C=CN(c1cc(F)ccc1)C2=O

InChI

InChI=1S/C22H19ClFN5O2/c1-14(12-20(30)25-17-7-5-15(23)6-8-17)11-19-26-27-21-22(31)28(9-10-29(19)21)18-4-2-3-16(24)13-18/h2-10,13-14H,11-12H2,1H3,(H,25,30)/t14-/m1/s1

InChI Key

KPOZYCXJPBIAHZ-CQSZACIVSA-N

MDL Number (MFCD)

MFCD27140612

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.88

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

2.838

Distribution Coefficient, logD

2.838

Water Solubility, LogSw

-3.52

Polar Surface Area

62.246

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with G423-0552 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G423-0552?
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What is the minimum amount of G423-0552 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G423-0552
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G423-0552
  • 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 G423-0552 available by request