8011-9025 Screening compound: 1-[4-(4-fluorobenzoyl)phenyl]azepane

8011-9025 Screening compound: 1-[4-(4-fluorobenzoyl)phenyl]azepane
8011-9025 Screening compound: 1-[4-(4-fluorobenzoyl)phenyl]azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-9025
1-[4-(4-fluorobenzoyl)phenyl]azepane

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

8011-9025

Molecular Formula

C19H20FNO (C19 H20 FNO)

Compound Name

1-[4-(4-fluorobenzoyl)phenyl]azepane

IUPAC name

1-[4-(4-fluorobenzoyl)phenyl]azepane

SMILES

O=C(c(cc1)ccc1N1CCCCCC1)c(cc1)ccc1F

InChI

InChI=1S/C19H20FNO/c20-17-9-5-15(6-10-17)19(22)16-7-11-18(12-8-16)21-13-3-1-2-4-14-21/h5-12H,1-4,13-14H2

InChI Key

DBRSBSXACDNBAH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02210617

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.37

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

4.816

Distribution Coefficient, logD

4.815

Water Solubility, LogSw

-4.78

Polar Surface Area

17.489

Acid Dissociation Constant (pKa)

27.56

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

8011-9025 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8011-9025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-9025?
Check Price and Availability of 8011-9025, 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 8011-9025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-9025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-9025
  • 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 8011-9025 available by request