G279-1164 Screening compound: N-[(2,3-dimethoxyphenyl)methyl]-4-{3-methyl-5-oxo-1-phenyl-1H,4H,5H,6H-pyrazolo[3,4-b][1,4]thiazin-4-yl}butanamide

G279-1164 Screening compound: N-[(2,3-dimethoxyphenyl)methyl]-4-{3-methyl-5-oxo-1-phenyl-1H,4H,5H,6H-pyrazolo[3,4-b][1,4]thiazin-4-yl}butanamide
G279-1164 Screening compound: N-[(2,3-dimethoxyphenyl)methyl]-4-{3-methyl-5-oxo-1-phenyl-1H,4H,5H,6H-pyrazolo[3,4-b][1,4]thiazin-4-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G279-1164
N-[(2,3-dimethoxyphenyl)methyl]-4-{3-methyl-5-oxo-1-phenyl-1H,4H,5H,6H-pyrazolo[3,4-b][1,4]thiazin-4-yl}butanamide

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

G279-1164

Molecular Formula

C25H28N4O4S (C25 H28 N4 O4 S)

Compound Name

N-[(2,3-dimethoxyphenyl)methyl]-4-{3-methyl-5-oxo-1-phenyl-1H,4H,5H,6H-pyrazolo[3,4-b][1,4]thiazin-4-yl}butanamide

IUPAC name

N-[(23-dimethoxyphenyl)methyl]-4-{3-methyl-5-oxo-1-phenyl-1H4H5H6H-pyrazolo[34-b][14]thiazin-4-yl}butanamide

SMILES

Cc(c(N1CCCC(NCc(cccc2OC)c2OC)=O)c2SCC1=O)nn2-c1ccccc1

InChI

InChI=1S/C25H28N4O4S/c1-17-23-25(29(27-17)19-10-5-4-6-11-19)34-16-22(31)28(23)14-8-13-21(30)26-15-18-9-7-12-20(32-2)24(18)33-3/h4-7,9-12H,8,13-16H2,1-3H3,(H,26,30)

InChI Key

PMGRDHVZWXILGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14993406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.588

Distribution Coefficient, logD

2.588

Water Solubility, LogSw

-2.95

Polar Surface Area

69.365

Acid Dissociation Constant (pKa)

13.51

Base Dissociation Constant (pKb)

0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

G279-1164 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Protein-Protein Interaction Library (218420 compounds)

Selective Target Activity Profiling Library (14702 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
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with G279-1164 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G279-1164?
Check Price and Availability of G279-1164, 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 G279-1164 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G279-1164
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G279-1164
  • 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 G279-1164 available by request