G361-0676 Screening compound: 2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]acetamide

G361-0676 Screening compound: 2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]acetamide
G361-0676 Screening compound: 2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G361-0676
2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]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

G361-0676

Molecular Formula

C25H35N7O2 (C25 H35 N7 O2)

Compound Name

2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-5-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]acetamide

IUPAC name

2-[2-(4-ethylphenyl)-7-methyl-4-oxo-4H5H-pyrazolo[15-d][124]triazin-5-yl]-N-[3-(4-ethylpiperazin-1-yl)propyl]acetamide

SMILES

CCc(cc1)ccc1-c(cc12)nn1C(C)=NN(CC(NCCCN1CCN(CC)CC1)=O)C2=O

InChI

InChI=1S/C25H35N7O2/c1-4-20-7-9-21(10-8-20)22-17-23-25(34)31(27-19(3)32(23)28-22)18-24(33)26-11-6-12-30-15-13-29(5-2)14-16-30/h7-10,17H,4-6,11-16,18H2,1-3H3,(H,26,33)

InChI Key

FNJQDTCDPFHQNL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15003254

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.075

Distribution Coefficient, logD

1.127

Water Solubility, LogSw

-2.79

Polar Surface Area

72.598

Acid Dissociation Constant (pKa)

16.02

Base Dissociation Constant (pKb)

8.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.00

G361-0676 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with G361-0676 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G361-0676?
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What is the minimum amount of G361-0676 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G361-0676
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G361-0676
  • 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 G361-0676 available by request