V009-0253 Screening compound: ethyl 2-(4-{[5-({2'-cyano-[1,1'-biphenyl]-4-yl}methoxy)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-2-oxoacetate

V009-0253 Screening compound: ethyl 2-(4-{[5-({2'-cyano-[1,1'-biphenyl]-4-yl}methoxy)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-2-oxoacetate
V009-0253 Screening compound: ethyl 2-(4-{[5-({2'-cyano-[1,1'-biphenyl]-4-yl}methoxy)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-2-oxoacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V009-0253
ethyl 2-(4-{[5-({2'-cyano-[1,1'-biphenyl]-4-yl}methoxy)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-2-oxoacetate

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

V009-0253

Molecular Formula

C28H27N3O6 (C28 H27 N3 O6)

Compound Name

ethyl 2-(4-{[5-({2'-cyano-[1,1'-biphenyl]-4-yl}methoxy)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-2-oxoacetate

IUPAC name

ethyl 2-(4-{[5-({2'-cyano-[11'-biphenyl]-4-yl}methoxy)-4-oxo-4H-pyran-2-yl]methyl}piperazin-1-yl)-2-oxoacetate

SMILES

CCOC(C(N1CCN(CC(OC=C2OCc(cc3)ccc3-c(cccc3)c3C#N)=CC2=O)CC1)=O)=O

InChI

InChI=1S/C28H27N3O6/c1-2-35-28(34)27(33)31-13-11-30(12-14-31)17-23-15-25(32)26(19-36-23)37-18-20-7-9-21(10-8-20)24-6-4-3-5-22(24)16-29/h3-10,15,19H,2,11-14,17-18H2,1H3

InChI Key

RBVVKLINXIRQKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19945906

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

501.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.405

Distribution Coefficient, logD

2.405

Water Solubility, LogSw

-2.79

Polar Surface Area

88.149

Acid Dissociation Constant (pKa)

28.36

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

V009-0253 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V009-0253 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V009-0253?
Check Price and Availability of V009-0253, 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 V009-0253 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V009-0253
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V009-0253
  • 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 V009-0253 available by request