V026-4494 Screening compound: 3-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl propane-2-sulfonate

V026-4494 Screening compound: 3-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl propane-2-sulfonate
V026-4494 Screening compound: 3-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl propane-2-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4494
3-{[1-(3-fluorophenyl)-N-(2-methoxyethyl)formamido]methyl}phenyl propane-2-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

V026-4494

Molecular Formula

C20H24FNO5S (C20 H24 FNO5 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C)S(Oc1cc(CN(CCOC)C(c2cc(F)ccc2)=O)ccc1)(=O)=O

InChI

InChI=1S/C20H24FNO5S/c1-15(2)28(24,25)27-19-9-4-6-16(12-19)14-22(10-11-26-3)20(23)17-7-5-8-18(21)13-17/h4-9,12-13,15H,10-11,14H2,1-3H3

InChI Key

CYYJDTFVIDXNEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19798515

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.48

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

2.746

Distribution Coefficient, logD

2.746

Water Solubility, LogSw

-3.17

Polar Surface Area

60.803

Acid Dissociation Constant (pKa)

19.26

Base Dissociation Constant (pKb)

-4.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

References: we are preparing a list of scientific research reports with V026-4494 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4494?
Check Price and Availability of V026-4494, 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 V026-4494 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4494
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4494
  • 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 V026-4494 available by request