1426-2812 Screening compound: N-(4-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide

1426-2812 Screening compound: N-(4-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
1426-2812 Screening compound: N-(4-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1426-2812
N-(4-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-3-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

1426-2812

Molecular Formula

C11H9ClN4O3 (C11 H9 ClN4 O3)

Compound Name

N-(4-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide

IUPAC name

N-(4-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide

SMILES

Cn1nc(C(Nc(cc2)ccc2Cl)=O)c([N+]([O-])=O)c1

InChI

InChI=1S/C11H9ClN4O3/c1-15-6-9(16(18)19)10(14-15)11(17)13-8-4-2-7(12)3-5-8/h2-6H,1H3,(H,13,17)

InChI Key

NDZGLBSMXINCHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00298427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.67

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.971

Distribution Coefficient, logD

1.818

Water Solubility, LogSw

-2.82

Polar Surface Area

71.766

Acid Dissociation Constant (pKa)

7.77

Base Dissociation Constant (pKb)

-2.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

1426-2812 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 1426-2812 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1426-2812?
Check Price and Availability of 1426-2812, 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 1426-2812 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1426-2812
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1426-2812
  • 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 1426-2812 available by request