8018-8861 Screening compound: N-(7-benzoyl-2,3-dihydro-1,4-benzodioxin-6-yl)-3-fluorobenzamide

8018-8861 Screening compound: N-(7-benzoyl-2,3-dihydro-1,4-benzodioxin-6-yl)-3-fluorobenzamide
8018-8861 Screening compound: N-(7-benzoyl-2,3-dihydro-1,4-benzodioxin-6-yl)-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8861
N-(7-benzoyl-2,3-dihydro-1,4-benzodioxin-6-yl)-3-fluorobenzamide

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

8018-8861

Molecular Formula

C22H16FNO4 (C22 H16 FNO4)

Compound Name

N-(7-benzoyl-2,3-dihydro-1,4-benzodioxin-6-yl)-3-fluorobenzamide

IUPAC name

N-(7-benzoyl-23-dihydro-14-benzodioxin-6-yl)-3-fluorobenzamide

SMILES

O=C(c1ccccc1)c(cc1OCCOc1c1)c1NC(c1cccc(F)c1)=O

InChI

InChI=1S/C22H16FNO4/c23-16-8-4-7-15(11-16)22(26)24-18-13-20-19(27-9-10-28-20)12-17(18)21(25)14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H,24,26)

InChI Key

GDUPOUXPXDQGSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08685680

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.121

Distribution Coefficient, logD

2.820

Water Solubility, LogSw

-3.57

Polar Surface Area

51.922

Acid Dissociation Constant (pKa)

7.40

Base Dissociation Constant (pKb)

-3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

8018-8861 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 8018-8861 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8861?
Check Price and Availability of 8018-8861, 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 8018-8861 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8861
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8861
  • 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 8018-8861 available by request