G395-0822 Screening compound: N-(4-acetylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

G395-0822 Screening compound: N-(4-acetylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
G395-0822 Screening compound: N-(4-acetylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G395-0822
N-(4-acetylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

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

G395-0822

Molecular Formula

C21H20N6O3 (C21 H20 N6 O3)

Compound Name

N-(4-acetylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

IUPAC name

N-(4-acetylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[124]triazolo[43-b]pyridazin-3-yl)propanamide

SMILES

CC(c(cc1)ccc1NC(CCc1nnc(cc2)n1nc2NCc1ccco1)=O)=O

InChI

InChI=1S/C21H20N6O3/c1-14(28)15-4-6-16(7-5-15)23-21(29)11-10-20-25-24-19-9-8-18(26-27(19)20)22-13-17-3-2-12-30-17/h2-9,12H,10-11,13H2,1H3,(H,22,26)(H,23,29)

InChI Key

NGNCAHPWUUISBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15007790

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.728

Distribution Coefficient, logD

1.727

Water Solubility, LogSw

-1.98

Polar Surface Area

88.900

Acid Dissociation Constant (pKa)

10.42

Base Dissociation Constant (pKb)

1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

G395-0822 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 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 G395-0822 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G395-0822?
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What is the minimum amount of G395-0822 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G395-0822
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G395-0822
  • 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 G395-0822 available by request