C202-2361 Screening compound: N-butyl-6-(4-ethoxyphenyl)-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxamide

C202-2361 Screening compound: N-butyl-6-(4-ethoxyphenyl)-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxamide
C202-2361 Screening compound: N-butyl-6-(4-ethoxyphenyl)-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-2361
N-butyl-6-(4-ethoxyphenyl)-3-(3-nitrophenyl)-2H-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

C202-2361

Molecular Formula

C25H25N5O4 (C25 H25 N5 O4)

Compound Name

N-butyl-6-(4-ethoxyphenyl)-3-(3-nitrophenyl)-2H-pyrazolo[3,4-b]pyridine-4-carboxamide

IUPAC name

N-butyl-6-(4-ethoxyphenyl)-3-(3-nitrophenyl)-2H-pyrazolo[34-b]pyridine-4-carboxamide

SMILES

CCCCNC(c1cc(-c(cc2)ccc2OCC)nc2n[nH]c(-c3cccc([N+]([O-])=O)c3)c12)=O

InChI

InChI=1S/C25H25N5O4/c1-3-5-13-26-25(31)20-15-21(16-9-11-19(12-10-16)34-4-2)27-24-22(20)23(28-29-24)17-7-6-8-18(14-17)30(32)33/h6-12,14-15H,3-5,13H2,1-2H3,(H,26,31)(H,27,28,29)

InChI Key

HKNSSRILNSXURP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14730942

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

6.140

Distribution Coefficient, logD

6.134

Water Solubility, LogSw

-5.68

Polar Surface Area

97.916

Acid Dissociation Constant (pKa)

4.10

Base Dissociation Constant (pKb)

1.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

C202-2361 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

CORONAVIRUS Library (20774 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with C202-2361 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-2361?
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What is the minimum amount of C202-2361 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-2361
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-2361
  • 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 C202-2361 available by request