F062-0117 Screening compound: 1,3,5-trimethyl-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrazole-4-sulfonamide

F062-0117 Screening compound: 1,3,5-trimethyl-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrazole-4-sulfonamide
F062-0117 Screening compound: 1,3,5-trimethyl-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrazole-4-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F062-0117
1,3,5-trimethyl-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrazole-4-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

F062-0117

Molecular Formula

C20H29N5O3S (C20 H29 N5 O3 S)

Compound Name

1,3,5-trimethyl-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrazole-4-sulfonamide

IUPAC name

135-trimethyl-N-(4-methylphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1H-pyrazole-4-sulfonamide

SMILES

Cc(n(C)nc1C)c1S(N(CC(N1CCN(C)CC1)=O)c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C20H29N5O3S/c1-15-6-8-18(9-7-15)25(14-19(26)24-12-10-22(4)11-13-24)29(27,28)20-16(2)21-23(5)17(20)3/h6-9H,10-14H2,1-5H3

InChI Key

NMRFNBGCFPNTHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27097819

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.410

Distribution Coefficient, logD

0.279

Water Solubility, LogSw

-2.10

Polar Surface Area

66.501

Acid Dissociation Constant (pKa)

21.05

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

F062-0117 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F062-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F062-0117?
Check Price and Availability of F062-0117, 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 F062-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F062-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F062-0117
  • 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 F062-0117 available by request