V028-0339 Screening compound: 2-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate

V028-0339 Screening compound: 2-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate
V028-0339 Screening compound: 2-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-0339
2-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-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

V028-0339

Molecular Formula

C25H27FN2O5S (C25 H27 FN2 O5 S)

Compound Name

2-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate

IUPAC name

2-({[(2-methoxyphenyl)carbamoyl](2-methylpropyl)amino}methyl)phenyl 4-fluorobenzene-1-sulfonate

SMILES

CC(C)CN(Cc(cccc1)c1OS(c(cc1)ccc1F)(=O)=O)C(Nc(cccc1)c1OC)=O

InChI

InChI=1S/C25H27FN2O5S/c1-18(2)16-28(25(29)27-22-9-5-7-11-24(22)32-3)17-19-8-4-6-10-23(19)33-34(30,31)21-14-12-20(26)13-15-21/h4-15,18H,16-17H2,1-3H3,(H,27,29)

InChI Key

OEQISYQVWKCSLX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19790150

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

486.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.674

Distribution Coefficient, logD

5.674

Water Solubility, LogSw

-5.49

Polar Surface Area

68.051

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with V028-0339 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-0339?
Check Price and Availability of V028-0339, 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 V028-0339 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-0339
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-0339
  • 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 V028-0339 available by request