M598-0312 Screening compound: N-{[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl}acetamide

M598-0312 Screening compound: N-{[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl}acetamide
M598-0312 Screening compound: N-{[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M598-0312
N-{[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl}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

M598-0312

Molecular Formula

C12H12ClN3O (C12 H12 ClN3 O)

Compound Name

N-{[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl}acetamide

IUPAC name

N-{[5-(4-chlorophenyl)-1H-pyrazol-4-yl]methyl}acetamide

SMILES

CC(NCc1c(-c(cc2)ccc2Cl)[nH]nc1)=O

InChI

InChI=1S/C12H12ClN3O/c1-8(17)14-6-10-7-15-16-12(10)9-2-4-11(13)5-3-9/h2-5,7H,6H2,1H3,(H,14,17)(H,15,16)

InChI Key

UMXPPQVUXUCYHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27548744

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

249.7

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.601

Distribution Coefficient, logD

1.601

Water Solubility, LogSw

-2.74

Polar Surface Area

49.012

Acid Dissociation Constant (pKa)

13.66

Base Dissociation Constant (pKb)

1.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

M598-0312 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

SmartTM Library (51161 compounds)

Soluble Diversity Library (15920 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M598-0312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M598-0312?
Check Price and Availability of M598-0312, 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 M598-0312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M598-0312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M598-0312
  • 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 M598-0312 available by request