V026-5746 Screening compound: 5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl ethane-1-sulfonate

V026-5746 Screening compound: 5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl ethane-1-sulfonate
V026-5746 Screening compound: 5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl ethane-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-5746
5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl ethane-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

V026-5746

Molecular Formula

C23H31FN2O5S (C23 H31 FN2 O5 S)

Compound Name

5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl ethane-1-sulfonate

IUPAC name

5-(diethylamino)-2-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl ethane-1-sulfonate

SMILES

CCN(CC)c1cc(OS(CC)(=O)=O)c(CN(CCOC)C(c2cc(F)ccc2)=O)cc1

InChI

InChI=1S/C23H31FN2O5S/c1-5-25(6-2)21-12-11-19(22(16-21)31-32(28,29)7-3)17-26(13-14-30-4)23(27)18-9-8-10-20(24)15-18/h8-12,15-16H,5-7,13-14,17H2,1-4H3

InChI Key

ZHWKYYLNFQDTRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19801028

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

466.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.352

Distribution Coefficient, logD

3.343

Water Solubility, LogSw

-3.52

Polar Surface Area

62.702

Acid Dissociation Constant (pKa)

21.62

Base Dissociation Constant (pKb)

5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

References: we are preparing a list of scientific research reports with V026-5746 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-5746?
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What is the minimum amount of V026-5746 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-5746
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-5746
  • 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 V026-5746 available by request