C561-2730 Screening compound: 1-(2-chlorophenyl)-3,6-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

C561-2730 Screening compound: 1-(2-chlorophenyl)-3,6-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
C561-2730 Screening compound: 1-(2-chlorophenyl)-3,6-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C561-2730
1-(2-chlorophenyl)-3,6-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

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

C561-2730

Molecular Formula

C22H24ClN5O2 (C22 H24 ClN5 O2)

Compound Name

1-(2-chlorophenyl)-3,6-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide

IUPAC name

1-(2-chlorophenyl)-36-dimethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazolo[34-b]pyridine-4-carboxamide

SMILES

Cc(c(c1nc(C)c2)c2C(NCCCN(CCC2)C2=O)=O)nn1-c(cccc1)c1Cl

InChI

InChI=1S/C22H24ClN5O2/c1-14-13-16(22(30)24-10-6-12-27-11-5-9-19(27)29)20-15(2)26-28(21(20)25-14)18-8-4-3-7-17(18)23/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,24,30)

InChI Key

RSIXUKZQXYADEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14771672

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.098

Distribution Coefficient, logD

2.098

Water Solubility, LogSw

-3.32

Polar Surface Area

64.907

Acid Dissociation Constant (pKa)

14.09

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

C561-2730 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C561-2730 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C561-2730?
Check Price and Availability of C561-2730, 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 C561-2730 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C561-2730
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C561-2730
  • 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 C561-2730 available by request