V026-4331 Screening compound: 2-{[1-(2-fluorophenyl)-N-(2-methylpropyl)formamido]methyl}phenyl 4-methoxybenzene-1-sulfonate

V026-4331 Screening compound: 2-{[1-(2-fluorophenyl)-N-(2-methylpropyl)formamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
V026-4331 Screening compound: 2-{[1-(2-fluorophenyl)-N-(2-methylpropyl)formamido]methyl}phenyl 4-methoxybenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4331
2-{[1-(2-fluorophenyl)-N-(2-methylpropyl)formamido]methyl}phenyl 4-methoxybenzene-1-sulfonate

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

V026-4331

Molecular Formula

C25H26FNO5S (C25 H26 FNO5 S)

Compound Name

2-{[1-(2-fluorophenyl)-N-(2-methylpropyl)formamido]methyl}phenyl 4-methoxybenzene-1-sulfonate

IUPAC name

2-{[1-(2-fluorophenyl)-N-(2-methylpropyl)formamido]methyl}phenyl 4-methoxybenzene-1-sulfonate

SMILES

CC(C)CN(Cc(cccc1)c1OS(c(cc1)ccc1OC)(=O)=O)C(c(cccc1)c1F)=O

InChI

InChI=1S/C25H26FNO5S/c1-18(2)16-27(25(28)22-9-5-6-10-23(22)26)17-19-8-4-7-11-24(19)32-33(29,30)21-14-12-20(31-3)13-15-21/h4-15,18H,16-17H2,1-3H3

InChI Key

XWFVJKPDLIRFDR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19784435

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.216

Distribution Coefficient, logD

5.216

Water Solubility, LogSw

-5.08

Polar Surface Area

59.841

Acid Dissociation Constant (pKa)

25.44

Base Dissociation Constant (pKb)

-4.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with V026-4331 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4331?
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What is the minimum amount of V026-4331 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4331
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4331
  • 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 V026-4331 available by request