V024-0449 Screening compound: 4-fluoro-N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)benzene-1-sulfonamide

V024-0449 Screening compound: 4-fluoro-N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)benzene-1-sulfonamide
V024-0449 Screening compound: 4-fluoro-N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-0449
4-fluoro-N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)benzene-1-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

V024-0449

Molecular Formula

C26H33F2N5O3S (C26 H33 F2 N5 O3 S)

Compound Name

4-fluoro-N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)benzene-1-sulfonamide

IUPAC name

4-fluoro-N-{[1-(3-fluorophenyl)-3-methyl-5-(4-methylpiperazin-1-yl)-1H-pyrazol-4-yl]methyl}-N-(3-methoxypropyl)benzene-1-sulfonamide

SMILES

Cc(c(CN(CCCOC)S(c(cc1)ccc1F)(=O)=O)c1N2CCN(C)CC2)nn1-c1cc(F)ccc1

InChI

InChI=1S/C26H33F2N5O3S/c1-20-25(19-32(12-5-17-36-3)37(34,35)24-10-8-21(27)9-11-24)26(31-15-13-30(2)14-16-31)33(29-20)23-7-4-6-22(28)18-23/h4,6-11,18H,5,12-17,19H2,1-3H3

InChI Key

OPNOHYQPFPTKIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19941927

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

533.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.797

Distribution Coefficient, logD

1.881

Water Solubility, LogSw

-4.03

Polar Surface Area

60.087

Acid Dissociation Constant (pKa)

23.51

Base Dissociation Constant (pKb)

9.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.30

V024-0449 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V024-0449 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-0449?
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What is the minimum amount of V024-0449 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-0449
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-0449
  • 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 V024-0449 available by request