F434-0636 Screening compound: 1-(4-chlorophenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-4-carboxamide

F434-0636 Screening compound: 1-(4-chlorophenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-4-carboxamide
F434-0636 Screening compound: 1-(4-chlorophenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F434-0636
1-(4-chlorophenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-4-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

F434-0636

Molecular Formula

C17H14ClN3OS (C17 H14 ClN3 OS)

Compound Name

1-(4-chlorophenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-4-carboxamide

IUPAC name

1-(4-chlorophenyl)-N-[3-(methylsulfanyl)phenyl]-1H-pyrazole-4-carboxamide

SMILES

CSc1cccc(NC(c2cn(-c(cc3)ccc3Cl)nc2)=O)c1

InChI

InChI=1S/C17H14ClN3OS/c1-23-16-4-2-3-14(9-16)20-17(22)12-10-19-21(11-12)15-7-5-13(18)6-8-15/h2-11H,1H3,(H,20,22)

InChI Key

HNLUMLDHGMVFGA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27128806

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.198

Distribution Coefficient, logD

4.198

Water Solubility, LogSw

-4.57

Polar Surface Area

37.687

Acid Dissociation Constant (pKa)

11.78

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

F434-0636 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F434-0636 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F434-0636?
Check Price and Availability of F434-0636, 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 F434-0636 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F434-0636
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F434-0636
  • 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 F434-0636 available by request