V025-4413 Screening compound: 2-{[(3,4-difluorophenyl)methyl](2-methylpropyl)amino}-N-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]acetamide

V025-4413 Screening compound: 2-{[(3,4-difluorophenyl)methyl](2-methylpropyl)amino}-N-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]acetamide
V025-4413 Screening compound: 2-{[(3,4-difluorophenyl)methyl](2-methylpropyl)amino}-N-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V025-4413
2-{[(3,4-difluorophenyl)methyl](2-methylpropyl)amino}-N-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]acetamide

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

V025-4413

Molecular Formula

C25H27F3N2O2 (C25 H27 F3 N2 O2)

Compound Name

2-{[(3,4-difluorophenyl)methyl](2-methylpropyl)amino}-N-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]acetamide

IUPAC name

2-{[(34-difluorophenyl)methyl](2-methylpropyl)amino}-N-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]acetamide

SMILES

CC(C)CN(CC(N(Cc1ccco1)Cc(cc1)ccc1F)=O)Cc(cc1)cc(F)c1F

InChI

InChI=1S/C25H27F3N2O2/c1-18(2)13-29(14-20-7-10-23(27)24(28)12-20)17-25(31)30(16-22-4-3-11-32-22)15-19-5-8-21(26)9-6-19/h3-12,18H,13-17H2,1-2H3

InChI Key

DLNFWFOSYXUXHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19842758

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

444.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.952

Distribution Coefficient, logD

4.950

Water Solubility, LogSw

-4.60

Polar Surface Area

27.383

Acid Dissociation Constant (pKa)

22.52

Base Dissociation Constant (pKb)

5.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.00

V025-4413 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with V025-4413 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V025-4413?
Check Price and Availability of V025-4413, 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 V025-4413 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V025-4413
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V025-4413
  • 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 V025-4413 available by request