V014-3068 Screening compound: 2,4-difluoro-N-[(7-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

V014-3068 Screening compound: 2,4-difluoro-N-[(7-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide
V014-3068 Screening compound: 2,4-difluoro-N-[(7-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V014-3068
2,4-difluoro-N-[(7-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

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

V014-3068

Molecular Formula

C16H12F3NO2 (C16 H12 F3 NO2)

Compound Name

2,4-difluoro-N-[(7-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]benzamide

IUPAC name

24-difluoro-N-[(7-fluoro-23-dihydro-1-benzofuran-2-yl)methyl]benzamide

SMILES

O=C(c(ccc(F)c1)c1F)NCC(C1)Oc2c1cccc2F

InChI

InChI=1S/C16H12F3NO2/c17-10-4-5-12(14(19)7-10)16(21)20-8-11-6-9-2-1-3-13(18)15(9)22-11/h1-5,7,11H,6,8H2,(H,20,21)/t11-/m1/s1

InChI Key

CLWUUQAZFUKEFM-LLVKDONJSA-N

MDL Number (MFCD)

MFCD19951478

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.27

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.515

Distribution Coefficient, logD

3.515

Water Solubility, LogSw

-3.73

Polar Surface Area

31.932

Acid Dissociation Constant (pKa)

11.14

Base Dissociation Constant (pKb)

-4.83

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

18.80

V014-3068 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V014-3068 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-3068?
Check Price and Availability of V014-3068, 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 V014-3068 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-3068
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-3068
  • 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 V014-3068 available by request