V027-2501 Screening compound: 3-{[N-(2-methylpropyl)-1-(thiophen-2-yl)formamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate

V027-2501 Screening compound: 3-{[N-(2-methylpropyl)-1-(thiophen-2-yl)formamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
V027-2501 Screening compound: 3-{[N-(2-methylpropyl)-1-(thiophen-2-yl)formamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-2501
3-{[N-(2-methylpropyl)-1-(thiophen-2-yl)formamido]methyl}phenyl 3-fluoro-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

V027-2501

Molecular Formula

C23H24FNO5S2 (C23 H24 FNO5 S2)

Compound Name

3-{[N-(2-methylpropyl)-1-(thiophen-2-yl)formamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate

IUPAC name

3-{[N-(2-methylpropyl)-1-(thiophen-2-yl)formamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate

SMILES

CC(C)CN(Cc1cccc(OS(c(cc2)cc(F)c2OC)(=O)=O)c1)C(c1cccs1)=O

InChI

InChI=1S/C23H24FNO5S2/c1-16(2)14-25(23(26)22-8-5-11-31-22)15-17-6-4-7-18(12-17)30-32(27,28)19-9-10-21(29-3)20(24)13-19/h4-13,16H,14-15H2,1-3H3

InChI Key

QNTNVEPPVTYKQZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20498150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.58

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

4.994

Distribution Coefficient, logD

4.994

Water Solubility, LogSw

-4.81

Polar Surface Area

60.860

Acid Dissociation Constant (pKa)

25.52

Base Dissociation Constant (pKb)

-1.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with V027-2501 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-2501?
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What is the minimum amount of V027-2501 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-2501
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-2501
  • 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 V027-2501 available by request