5551-0314 Screening compound: 2-(2-chlorophenoxy)-N'-(3-methyl-1H-pyrazole-5-carbonyl)acetohydrazide

5551-0314 Screening compound: 2-(2-chlorophenoxy)-N'-(3-methyl-1H-pyrazole-5-carbonyl)acetohydrazide
5551-0314 Screening compound: 2-(2-chlorophenoxy)-N'-(3-methyl-1H-pyrazole-5-carbonyl)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5551-0314
2-(2-chlorophenoxy)-N'-(3-methyl-1H-pyrazole-5-carbonyl)acetohydrazide

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

5551-0314

Molecular Formula

C13H13ClN4O3 (C13 H13 ClN4 O3)

Compound Name

2-(2-chlorophenoxy)-N'-(3-methyl-1H-pyrazole-5-carbonyl)acetohydrazide

IUPAC name

2-(2-chlorophenoxy)-N'-(3-methyl-1H-pyrazole-5-carbonyl)acetohydrazide

SMILES

Cc1n[nH]c(C(NNC(COc(cccc2)c2Cl)=O)=O)c1

InChI

InChI=1S/C13H13ClN4O3/c1-8-6-10(16-15-8)13(20)18-17-12(19)7-21-11-5-3-2-4-9(11)14/h2-6H,7H2,1H3,(H,15,16)(H,17,19)(H,18,20)

InChI Key

WNZNKDYDTQXXFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03372916

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.72

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.208

Distribution Coefficient, logD

1.207

Water Solubility, LogSw

-2.57

Polar Surface Area

81.375

Acid Dissociation Constant (pKa)

10.02

Base Dissociation Constant (pKb)

0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

5551-0314 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with 5551-0314 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5551-0314?
Check Price and Availability of 5551-0314, 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 5551-0314 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5551-0314
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5551-0314
  • 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 5551-0314 available by request