V001-8539 Screening compound: N~1~-cyclopropyl-N~1~-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-4-methoxy-1-benzenesulfonamide

V001-8539 Screening compound: N~1~-cyclopropyl-N~1~-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-4-methoxy-1-benzenesulfonamide
V001-8539 Screening compound: N~1~-cyclopropyl-N~1~-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-4-methoxy-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-8539
N~1~-cyclopropyl-N~1~-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-4-methoxy-1-benzenesulfonamide

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

V001-8539

Molecular Formula

C23H25F3N4O3S (C23 H25 F3 N4 O3 S)

Compound Name

N~1~-cyclopropyl-N~1~-{[5-(dimethylamino)-1-phenyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl}-4-methoxy-1-benzenesulfonamide

IUPAC name

n/a

SMILES

CN(C)c1c(CN(C2CC2)S(c(cc2)ccc2OC)(=O)=O)c(C(F)(F)F)nn1-c1ccccc1

InChI

InChI=1S/C23H25F3N4O3S/c1-28(2)22-20(21(23(24,25)26)27-30(22)17-7-5-4-6-8-17)15-29(16-9-10-16)34(31,32)19-13-11-18(33-3)12-14-19/h4-8,11-14,16H,9-10,15H2,1-3H3

InChI Key

HQLLSQCSBGMGGN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19807488

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

494.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.716

Distribution Coefficient, logD

4.716

Water Solubility, LogSw

-4.51

Polar Surface Area

55.722

Acid Dissociation Constant (pKa)

22.92

Base Dissociation Constant (pKb)

-2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

V001-8539 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Anti-HIV1 Library (19540 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with V001-8539 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-8539?
Check Price and Availability of V001-8539, 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 V001-8539 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-8539
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-8539
  • 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 V001-8539 available by request