V030-4093 Screening compound: N-cyclohexyl-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide

V030-4093 Screening compound: N-cyclohexyl-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
V030-4093 Screening compound: N-cyclohexyl-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-4093
N-cyclohexyl-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide

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

V030-4093

Molecular Formula

C25H28N4O6 (C25 H28 N4 O6)

Compound Name

N-cyclohexyl-N-{2-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide

IUPAC name

N-cyclohexyl-N-{2-[3-(34-dimethoxyphenyl)-124-oxadiazol-5-yl]ethyl}-3-nitrobenzamide

SMILES

COc(ccc(-c1noc(CCN(C2CCCCC2)C(c2cccc([N+]([O-])=O)c2)=O)n1)c1)c1OC

InChI

InChI=1S/C25H28N4O6/c1-33-21-12-11-17(16-22(21)34-2)24-26-23(35-27-24)13-14-28(19-8-4-3-5-9-19)25(30)18-7-6-10-20(15-18)29(31)32/h6-7,10-12,15-16,19H,3-5,8-9,13-14H2,1-2H3

InChI Key

PUXBKMZTZRCTDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20493713

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

480.52

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

5.155

Distribution Coefficient, logD

5.155

Water Solubility, LogSw

-5.06

Polar Surface Area

95.386

Acid Dissociation Constant (pKa)

26.97

Base Dissociation Constant (pKb)

-2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V030-4093 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V030-4093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-4093?
Check Price and Availability of V030-4093, 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 V030-4093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-4093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-4093
  • 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 V030-4093 available by request