G361-0423 Screening compound: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]acetamide

G361-0423 Screening compound: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]acetamide
G361-0423 Screening compound: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G361-0423
N-[3-(4-benzylpiperazin-1-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxo-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

G361-0423

Molecular Formula

C28H33N7O3 (C28 H33 N7 O3)

Compound Name

N-[3-(4-benzylpiperazin-1-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]acetamide

IUPAC name

N-[3-(4-benzylpiperazin-1-yl)propyl]-2-[2-(4-methoxyphenyl)-4-oxo-4H5H-pyrazolo[15-d][124]triazin-5-yl]acetamide

SMILES

COc(cc1)ccc1-c1nn(C=NN(CC(NCCCN2CCN(Cc3ccccc3)CC2)=O)C2=O)c2c1

InChI

InChI=1S/C28H33N7O3/c1-38-24-10-8-23(9-11-24)25-18-26-28(37)34(30-21-35(26)31-25)20-27(36)29-12-5-13-32-14-16-33(17-15-32)19-22-6-3-2-4-7-22/h2-4,6-11,18,21H,5,12-17,19-20H2,1H3,(H,29,36)

InChI Key

IXFZAIVEVDGEHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15003148

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

515.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.520

Distribution Coefficient, logD

0.701

Water Solubility, LogSw

-2.33

Polar Surface Area

81.525

Acid Dissociation Constant (pKa)

16.02

Base Dissociation Constant (pKb)

8.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.70

G361-0423 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G361-0423 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G361-0423?
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What is the minimum amount of G361-0423 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G361-0423
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G361-0423
  • 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 G361-0423 available by request