V011-0289 Screening compound: 2-{[(4-cyanophenyl)methyl][(oxolan-2-yl)methyl]amino}-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)acetamide

V011-0289 Screening compound: 2-{[(4-cyanophenyl)methyl][(oxolan-2-yl)methyl]amino}-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)acetamide
V011-0289 Screening compound: 2-{[(4-cyanophenyl)methyl][(oxolan-2-yl)methyl]amino}-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-0289
2-{[(4-cyanophenyl)methyl][(oxolan-2-yl)methyl]amino}-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)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

V011-0289

Molecular Formula

C29H33N3O3 (C29 H33 N3 O3)

Compound Name

2-{[(4-cyanophenyl)methyl][(oxolan-2-yl)methyl]amino}-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)acetamide

IUPAC name

2-{[(4-cyanophenyl)methyl][(oxolan-2-yl)methyl]amino}-N-[(5-methylfuran-2-yl)methyl]-N-(2-phenylethyl)acetamide

SMILES

Cc1ccc(CN(CCc2ccccc2)C(CN(CC2OCCC2)Cc(cc2)ccc2C#N)=O)o1

InChI

InChI=1S/C29H33N3O3/c1-23-9-14-28(35-23)21-32(16-15-24-6-3-2-4-7-24)29(33)22-31(20-27-8-5-17-34-27)19-26-12-10-25(18-30)11-13-26/h2-4,6-7,9-14,27H,5,8,15-17,19-22H2,1H3/t27-/m1/s1

InChI Key

ONCLRNBQEQUMHO-HHHXNRCGSA-N

MDL Number (MFCD)

MFCD19978652

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

471.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.946

Distribution Coefficient, logD

3.946

Water Solubility, LogSw

-3.93

Polar Surface Area

52.314

Acid Dissociation Constant (pKa)

22.53

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

37.90

V011-0289 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 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 V011-0289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-0289?
Check Price and Availability of V011-0289, 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 V011-0289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-0289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-0289
  • 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 V011-0289 available by request