G395-0825 Screening compound: N-(2,5-dimethylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

G395-0825 Screening compound: N-(2,5-dimethylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide
G395-0825 Screening compound: N-(2,5-dimethylphenyl)-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 G395-0825
N-(2,5-dimethylphenyl)-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

G395-0825

Molecular Formula

C21H22N6O2 (C21 H22 N6 O2)

Compound Name

N-(2,5-dimethylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

IUPAC name

N-(25-dimethylphenyl)-3-(6-{[(furan-2-yl)methyl]amino}-[124]triazolo[43-b]pyridazin-3-yl)propanamide

SMILES

Cc1cc(NC(CCc2nnc(cc3)n2nc3NCc2ccco2)=O)c(C)cc1

InChI

InChI=1S/C21H22N6O2/c1-14-5-6-15(2)17(12-14)23-21(28)10-9-20-25-24-19-8-7-18(26-27(19)20)22-13-16-4-3-11-29-16/h3-8,11-12H,9-10,13H2,1-2H3,(H,22,26)(H,23,28)

InChI Key

ZMDXGMRVVHDHQH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15007792

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.227

Distribution Coefficient, logD

2.227

Water Solubility, LogSw

-2.68

Polar Surface Area

74.375

Acid Dissociation Constant (pKa)

12.46

Base Dissociation Constant (pKb)

1.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G395-0825 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 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 G395-0825 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G395-0825?
Check Price and Availability of G395-0825, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of G395-0825 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G395-0825
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G395-0825
  • 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 G395-0825 available by request