P898-0161 Screening compound: N-[(3-methoxyphenyl)methyl]-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide

P898-0161 Screening compound: N-[(3-methoxyphenyl)methyl]-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide
P898-0161 Screening compound: N-[(3-methoxyphenyl)methyl]-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P898-0161
N-[(3-methoxyphenyl)methyl]-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-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

P898-0161

Molecular Formula

C21H24N4O5S (C21 H24 N4 O5 S)

Compound Name

N-[(3-methoxyphenyl)methyl]-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-5-[4-(piperidine-1-carbonyl)-1H-pyrazol-5-yl]furan-2-sulfonamide

SMILES

COc1cccc(CNS(c2ccc(-c([nH]nc3)c3C(N3CCCCC3)=O)o2)(=O)=O)c1

InChI

InChI=1S/C21H24N4O5S/c1-29-16-7-5-6-15(12-16)13-23-31(27,28)19-9-8-18(30-19)20-17(14-22-24-20)21(26)25-10-3-2-4-11-25/h5-9,12,14,23H,2-4,10-11,13H2,1H3,(H,22,24)

InChI Key

HTAIHQARPSJIFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29027417

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.51

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.808

Distribution Coefficient, logD

2.807

Water Solubility, LogSw

-3.40

Polar Surface Area

99.270

Acid Dissociation Constant (pKa)

10.25

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with P898-0161 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P898-0161?
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What is the minimum amount of P898-0161 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P898-0161
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P898-0161
  • 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 P898-0161 available by request