V006-5582 Screening compound: 3-{[N-(2-methoxyethyl)heptanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate

V006-5582 Screening compound: 3-{[N-(2-methoxyethyl)heptanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
V006-5582 Screening compound: 3-{[N-(2-methoxyethyl)heptanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V006-5582
3-{[N-(2-methoxyethyl)heptanamido]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

V006-5582

Molecular Formula

C23H30FNO5S (C23 H30 FNO5 S)

Compound Name

3-{[N-(2-methoxyethyl)heptanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate

IUPAC name

3-{[N-(2-methoxyethyl)heptanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate

SMILES

CCCCCCC(N(CCOC)Cc1cccc(OS(c(cc2)ccc2F)(=O)=O)c1)=O

InChI

InChI=1S/C23H30FNO5S/c1-3-4-5-6-10-23(26)25(15-16-29-2)18-19-8-7-9-21(17-19)30-31(27,28)22-13-11-20(24)12-14-22/h7-9,11-14,17H,3-6,10,15-16,18H2,1-2H3

InChI Key

UPKXQBJVYZUAPR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19745869

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.763

Distribution Coefficient, logD

4.763

Water Solubility, LogSw

-4.61

Polar Surface Area

60.276

Acid Dissociation Constant (pKa)

23.89

Base Dissociation Constant (pKb)

-1.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.48

References: we are preparing a list of scientific research reports with V006-5582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V006-5582?
Check Price and Availability of V006-5582, 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 V006-5582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V006-5582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V006-5582
  • 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 V006-5582 available by request