G419-0696 Screening compound: 2-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]-N-(3-chloro-4-methoxyphenyl)acetamide

G419-0696 Screening compound: 2-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]-N-(3-chloro-4-methoxyphenyl)acetamide
G419-0696 Screening compound: 2-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]-N-(3-chloro-4-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G419-0696
2-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]-N-(3-chloro-4-methoxyphenyl)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

G419-0696

Molecular Formula

C22H17ClN4O5 (C22 H17 ClN4 O5)

Compound Name

2-[2-(2H-1,3-benzodioxol-5-yl)-4-oxo-4H,5H-pyrazolo[1,5-a]pyrazin-5-yl]-N-(3-chloro-4-methoxyphenyl)acetamide

IUPAC name

2-[2-(2H-13-benzodioxol-5-yl)-4-oxo-4H5H-pyrazolo[15-a]pyrazin-5-yl]-N-(3-chloro-4-methoxyphenyl)acetamide

SMILES

COc(ccc(NC(CN(C=Cn(c1c2)nc2-c(cc2)cc3c2OCO3)C1=O)=O)c1)c1Cl

InChI

InChI=1S/C22H17ClN4O5/c1-30-18-5-3-14(9-15(18)23)24-21(28)11-26-6-7-27-17(22(26)29)10-16(25-27)13-2-4-19-20(8-13)32-12-31-19/h2-10H,11-12H2,1H3,(H,24,28)

InChI Key

LRGBSFKDBLJULU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18788235

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.85

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.850

Distribution Coefficient, logD

2.849

Water Solubility, LogSw

-3.53

Polar Surface Area

75.866

Acid Dissociation Constant (pKa)

10.62

Base Dissociation Constant (pKb)

0.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

G419-0696 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with G419-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G419-0696?
Check Price and Availability of G419-0696, 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 G419-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G419-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G419-0696
  • 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 G419-0696 available by request