8014-5067 Screening compound: 1-(3-chloro-4-methylphenyl)-3,5-dimethyl-1H-pyrazole

8014-5067 Screening compound: 1-(3-chloro-4-methylphenyl)-3,5-dimethyl-1H-pyrazole
8014-5067 Screening compound: 1-(3-chloro-4-methylphenyl)-3,5-dimethyl-1H-pyrazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-5067
1-(3-chloro-4-methylphenyl)-3,5-dimethyl-1H-pyrazole

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

8014-5067

Molecular Formula

C12H13ClN2 (C12 H13 ClN2)

Compound Name

1-(3-chloro-4-methylphenyl)-3,5-dimethyl-1H-pyrazole

IUPAC name

1-(3-chloro-4-methylphenyl)-35-dimethyl-1H-pyrazole

SMILES

Cc1cc(C)nn1-c1cc(Cl)c(C)cc1

InChI

InChI=1S/C12H13ClN2/c1-8-4-5-11(7-12(8)13)15-10(3)6-9(2)14-15/h4-7H,1-3H3

InChI Key

LECUQHBXEKGXHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03307479

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

220.7

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.393

Distribution Coefficient, logD

3.393

Water Solubility, LogSw

-3.54

Polar Surface Area

14.110

Acid Dissociation Constant (pKa)

27.17

Base Dissociation Constant (pKb)

3.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

8014-5067 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8014-5067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-5067?
Check Price and Availability of 8014-5067, 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 8014-5067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-5067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-5067
  • 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 8014-5067 available by request