V006-5590 Screening compound: 4-({N-[2-(dimethylamino)ethyl]octanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate

V006-5590 Screening compound: 4-({N-[2-(dimethylamino)ethyl]octanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
V006-5590 Screening compound: 4-({N-[2-(dimethylamino)ethyl]octanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-5590
4-({N-[2-(dimethylamino)ethyl]octanamido}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

V006-5590

Molecular Formula

C25H35FN2O4S (C25 H35 FN2 O4 S)

Compound Name

4-({N-[2-(dimethylamino)ethyl]octanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate

IUPAC name

4-({N-[2-(dimethylamino)ethyl]octanamido}methyl)phenyl 4-fluorobenzene-1-sulfonate

SMILES

CCCCCCCC(N(CCN(C)C)Cc(cc1)ccc1OS(c(cc1)ccc1F)(=O)=O)=O

InChI

InChI=1S/C25H35FN2O4S/c1-4-5-6-7-8-9-25(29)28(19-18-27(2)3)20-21-10-14-23(15-11-21)32-33(30,31)24-16-12-22(26)13-17-24/h10-17H,4-9,18-20H2,1-3H3

InChI Key

JKRSFSGBWKSQEY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19973201

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

478.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

15.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.205

Distribution Coefficient, logD

4.316

Water Solubility, LogSw

-4.90

Polar Surface Area

55.799

Acid Dissociation Constant (pKa)

23.89

Base Dissociation Constant (pKb)

8.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

References: we are preparing a list of scientific research reports with V006-5590 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-5590?
Check Price and Availability of V006-5590, 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 V006-5590 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-5590
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-5590
  • 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 V006-5590 available by request