V016-6046 Screening compound: 1-[5-(4-fluorophenyl)thiophene-2-carbonyl]azocane

V016-6046 Screening compound: 1-[5-(4-fluorophenyl)thiophene-2-carbonyl]azocane
V016-6046 Screening compound: 1-[5-(4-fluorophenyl)thiophene-2-carbonyl]azocane alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-6046
1-[5-(4-fluorophenyl)thiophene-2-carbonyl]azocane

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

V016-6046

Molecular Formula

C18H20FNOS (C18 H20 FNOS)

Compound Name

1-[5-(4-fluorophenyl)thiophene-2-carbonyl]azocane

IUPAC name

1-[5-(4-fluorophenyl)thiophene-2-carbonyl]azocane

SMILES

O=C(c1ccc(-c(cc2)ccc2F)s1)N1CCCCCCC1

InChI

InChI=1S/C18H20FNOS/c19-15-8-6-14(7-9-15)16-10-11-17(22-16)18(21)20-12-4-2-1-3-5-13-20/h6-11H,1-5,12-13H2

InChI Key

BZIYNMKDRXKDNK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19944611

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.43

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.373

Distribution Coefficient, logD

5.373

Water Solubility, LogSw

-5.62

Polar Surface Area

17.965

Acid Dissociation Constant (pKa)

28.10

Base Dissociation Constant (pKb)

-0.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

V016-6046 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with V016-6046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-6046?
Check Price and Availability of V016-6046, 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 V016-6046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-6046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-6046
  • 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 V016-6046 available by request