V006-5780 Screening compound: 3-[(N-cyclopropyl-2-phenoxyacetamido)methyl]phenyl 4-fluorobenzene-1-sulfonate

V006-5780 Screening compound: 3-[(N-cyclopropyl-2-phenoxyacetamido)methyl]phenyl 4-fluorobenzene-1-sulfonate
V006-5780 Screening compound: 3-[(N-cyclopropyl-2-phenoxyacetamido)methyl]phenyl 4-fluorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-5780
3-[(N-cyclopropyl-2-phenoxyacetamido)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

V006-5780

Molecular Formula

C24H22FNO5S (C24 H22 FNO5 S)

Compound Name

3-[(N-cyclopropyl-2-phenoxyacetamido)methyl]phenyl 4-fluorobenzene-1-sulfonate

IUPAC name

3-[(N-cyclopropyl-2-phenoxyacetamido)methyl]phenyl 4-fluorobenzene-1-sulfonate

SMILES

O=C(COc1ccccc1)N(Cc1cccc(OS(c(cc2)ccc2F)(=O)=O)c1)C1CC1

InChI

InChI=1S/C24H22FNO5S/c25-19-9-13-23(14-10-19)32(28,29)31-22-8-4-5-18(15-22)16-26(20-11-12-20)24(27)17-30-21-6-2-1-3-7-21/h1-10,13-15,20H,11-12,16-17H2

InChI Key

HATOTODPXFYMPG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19973093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.51

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

4.310

Distribution Coefficient, logD

4.310

Water Solubility, LogSw

-4.47

Polar Surface Area

58.487

Acid Dissociation Constant (pKa)

25.23

Base Dissociation Constant (pKb)

-1.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.80

References: we are preparing a list of scientific research reports with V006-5780 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-5780?
Check Price and Availability of V006-5780, 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 V006-5780 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-5780
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-5780
  • 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 V006-5780 available by request