G361-0047 Screening compound: N-[(4-fluorophenyl)methyl]-2-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl}acetamide

G361-0047 Screening compound: N-[(4-fluorophenyl)methyl]-2-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl}acetamide
G361-0047 Screening compound: N-[(4-fluorophenyl)methyl]-2-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G361-0047
N-[(4-fluorophenyl)methyl]-2-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl}acetamide

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

G361-0047

Molecular Formula

C20H16FN5O2 (C20 H16 FN5 O2)

Compound Name

N-[(4-fluorophenyl)methyl]-2-{4-oxo-2-phenyl-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl}acetamide

IUPAC name

N-[(4-fluorophenyl)methyl]-2-{4-oxo-2-phenyl-4H5H-pyrazolo[15-d][124]triazin-5-yl}acetamide

SMILES

O=C(CN(C(c1c2)=O)N=Cn1nc2-c1ccccc1)NCc(cc1)ccc1F

InChI

InChI=1S/C20H16FN5O2/c21-16-8-6-14(7-9-16)11-22-19(27)12-25-20(28)18-10-17(24-26(18)13-23-25)15-4-2-1-3-5-15/h1-10,13H,11-12H2,(H,22,27)

InChI Key

QCBICPRCNFMYTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09980163

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.014

Distribution Coefficient, logD

2.014

Water Solubility, LogSw

-2.69

Polar Surface Area

66.617

Acid Dissociation Constant (pKa)

13.09

Base Dissociation Constant (pKb)

0.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

G361-0047 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G361-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G361-0047?
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What is the minimum amount of G361-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G361-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G361-0047
  • 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 G361-0047 available by request