C434-0127 Screening compound: N-(2-methylphenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-propylacetamide

C434-0127 Screening compound: N-(2-methylphenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-propylacetamide
C434-0127 Screening compound: N-(2-methylphenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-propylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C434-0127
N-(2-methylphenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-propylacetamide

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

C434-0127

Molecular Formula

C22H21N3O3 (C22 H21 N3 O3)

Compound Name

N-(2-methylphenyl)-2-{4-oxo-1H,4H-chromeno[4,3-c]pyrazol-1-yl}-N-propylacetamide

IUPAC name

N-(2-methylphenyl)-2-{4-oxo-1H4H-chromeno[43-c]pyrazol-1-yl}-N-propylacetamide

SMILES

CCCN(C(Cn1ncc2c1-c(cccc1)c1OC2=O)=O)c1c(C)cccc1

InChI

InChI=1S/C22H21N3O3/c1-3-12-24(18-10-6-4-8-15(18)2)20(26)14-25-21-16-9-5-7-11-19(16)28-22(27)17(21)13-23-25/h4-11,13H,3,12,14H2,1-2H3

InChI Key

MJPUAUZZEGQPQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14757391

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.687

Distribution Coefficient, logD

3.687

Water Solubility, LogSw

-3.91

Polar Surface Area

49.503

Acid Dissociation Constant (pKa)

22.65

Base Dissociation Constant (pKb)

-0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

C434-0127 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
  • Epigenetic
Therapeutical areas:
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic

References: we are preparing a list of scientific research reports with C434-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C434-0127?
Check Price and Availability of C434-0127, 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 C434-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C434-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C434-0127
  • 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 C434-0127 available by request