S055-0424 Screening compound: 4-chloro-1-ethyl-N-[(2-phenoxypyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide

S055-0424 Screening compound: 4-chloro-1-ethyl-N-[(2-phenoxypyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide
S055-0424 Screening compound: 4-chloro-1-ethyl-N-[(2-phenoxypyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S055-0424
4-chloro-1-ethyl-N-[(2-phenoxypyridin-3-yl)methyl]-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

S055-0424

Molecular Formula

C18H17ClN4O2 (C18 H17 ClN4 O2)

Compound Name

4-chloro-1-ethyl-N-[(2-phenoxypyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide

IUPAC name

4-chloro-1-ethyl-N-[(2-phenoxypyridin-3-yl)methyl]-1H-pyrazole-3-carboxamide

SMILES

CCn1nc(C(NCc(cccn2)c2Oc2ccccc2)=O)c(Cl)c1

InChI

InChI=1S/C18H17ClN4O2/c1-2-23-12-15(19)16(22-23)17(24)21-11-13-7-6-10-20-18(13)25-14-8-4-3-5-9-14/h3-10,12H,2,11H2,1H3,(H,21,24)

InChI Key

DVAJSWQQAUSFGW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.81

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.302

Distribution Coefficient, logD

3.302

Water Solubility, LogSw

-3.58

Polar Surface Area

56.253

Acid Dissociation Constant (pKa)

11.75

Base Dissociation Constant (pKb)

0.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

S055-0424 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with S055-0424 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S055-0424?
Check Price and Availability of S055-0424, 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 S055-0424 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S055-0424
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S055-0424
  • 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 S055-0424 available by request