V030-9396 Screening compound: {4-[bis(4-fluorophenyl)methyl]piperazino}(2-furyl)methanone

V030-9396 Screening compound: {4-[bis(4-fluorophenyl)methyl]piperazino}(2-furyl)methanone
V030-9396 Screening compound: {4-[bis(4-fluorophenyl)methyl]piperazino}(2-furyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-9396
{4-[bis(4-fluorophenyl)methyl]piperazino}(2-furyl)methanone

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

V030-9396

Molecular Formula

C22H20F2N2O2 (C22 H20 F2 N2 O2)

Compound Name

{4-[bis(4-fluorophenyl)methyl]piperazino}(2-furyl)methanone

IUPAC name

1-[bis(4-fluorophenyl)methyl]-4-(furan-2-carbonyl)piperazine

SMILES

O=C(c1ccco1)N(CC1)CCN1C(c(cc1)ccc1F)c(cc1)ccc1F

InChI

InChI=1S/C22H20F2N2O2/c23-18-7-3-16(4-8-18)21(17-5-9-19(24)10-6-17)25-11-13-26(14-12-25)22(27)20-2-1-15-28-20/h1-10,15,21H,11-14H2

InChI Key

NCYCIQRVBBMNQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD17587585

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

382.41

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.829

Distribution Coefficient, logD

3.829

Water Solubility, LogSw

-4.01

Polar Surface Area

28.026

Acid Dissociation Constant (pKa)

24.12

Base Dissociation Constant (pKb)

4.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.73

V030-9396 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

DGK Inhibitors Library (10558 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V030-9396 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-9396?
Check Price and Availability of V030-9396, 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 V030-9396 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-9396
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-9396
  • 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 V030-9396 available by request