V003-2067 Screening compound: 5-({[(2-fluorophenyl)carbamoyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate

V003-2067 Screening compound: 5-({[(2-fluorophenyl)carbamoyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate
V003-2067 Screening compound: 5-({[(2-fluorophenyl)carbamoyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-2067
5-({[(2-fluorophenyl)carbamoyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-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

V003-2067

Molecular Formula

C25H24F4N2O5S (C25 H24 F4 N2 O5 S)

Compound Name

5-({[(2-fluorophenyl)carbamoyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate

IUPAC name

5-({[(2-fluorophenyl)carbamoyl](propan-2-yl)amino}methyl)-2-methoxyphenyl 3-(trifluoromethyl)benzene-1-sulfonate

SMILES

CC(C)N(Cc(cc1)cc(OS(c2cc(C(F)(F)F)ccc2)(=O)=O)c1OC)C(Nc(cccc1)c1F)=O

InChI

InChI=1S/C25H24F4N2O5S/c1-16(2)31(24(32)30-21-10-5-4-9-20(21)26)15-17-11-12-22(35-3)23(13-17)36-37(33,34)19-8-6-7-18(14-19)25(27,28)29/h4-14,16H,15H2,1-3H3,(H,30,32)

InChI Key

DSIUHQJYKVAVRV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19751374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

540.54

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

5.366

Distribution Coefficient, logD

5.366

Water Solubility, LogSw

-5.49

Polar Surface Area

67.795

Acid Dissociation Constant (pKa)

12.83

Base Dissociation Constant (pKb)

-2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with V003-2067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-2067?
Check Price and Availability of V003-2067, 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 V003-2067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-2067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-2067
  • 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 V003-2067 available by request