P174-0061 Screening compound: N-(3-chloro-2-methylphenyl)-2-methyl-5-(1H-pyrazol-5-yl)furan-3-sulfonamide

P174-0061 Screening compound: N-(3-chloro-2-methylphenyl)-2-methyl-5-(1H-pyrazol-5-yl)furan-3-sulfonamide
P174-0061 Screening compound: N-(3-chloro-2-methylphenyl)-2-methyl-5-(1H-pyrazol-5-yl)furan-3-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P174-0061
N-(3-chloro-2-methylphenyl)-2-methyl-5-(1H-pyrazol-5-yl)furan-3-sulfonamide

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

P174-0061

Molecular Formula

C15H14ClN3O3S (C15 H14 ClN3 O3 S)

Compound Name

N-(3-chloro-2-methylphenyl)-2-methyl-5-(1H-pyrazol-5-yl)furan-3-sulfonamide

IUPAC name

N-(3-chloro-2-methylphenyl)-2-methyl-5-(1H-pyrazol-5-yl)furan-3-sulfonamide

SMILES

Cc(oc(-c1ccn[nH]1)c1)c1S(Nc1cccc(Cl)c1C)(=O)=O

InChI

InChI=1S/C15H14ClN3O3S/c1-9-11(16)4-3-5-12(9)19-23(20,21)15-8-14(22-10(15)2)13-6-7-17-18-13/h3-8,19H,1-2H3,(H,17,18)

InChI Key

JVEDYSDDSIVTII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27567964

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.81

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.438

Distribution Coefficient, logD

2.816

Water Solubility, LogSw

-3.73

Polar Surface Area

71.846

Acid Dissociation Constant (pKa)

6.90

Base Dissociation Constant (pKb)

3.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

P174-0061 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with P174-0061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P174-0061?
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What is the minimum amount of P174-0061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P174-0061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P174-0061
  • 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 P174-0061 available by request