V029-3380 Screening compound: 2-(benzyloxy)-N-(butan-2-yl)-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}acetamide

V029-3380 Screening compound: 2-(benzyloxy)-N-(butan-2-yl)-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}acetamide
V029-3380 Screening compound: 2-(benzyloxy)-N-(butan-2-yl)-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-3380
2-(benzyloxy)-N-(butan-2-yl)-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}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

V029-3380

Molecular Formula

C23H26N4O5 (C23 H26 N4 O5)

Compound Name

2-(benzyloxy)-N-(butan-2-yl)-N-{2-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]ethyl}acetamide

IUPAC name

2-(benzyloxy)-N-(butan-2-yl)-N-{2-[3-(3-nitrophenyl)-124-oxadiazol-5-yl]ethyl}acetamide

SMILES

CCC(C)N(CCc1nc(-c2cccc([N+]([O-])=O)c2)no1)C(COCc1ccccc1)=O

InChI

InChI=1S/C23H26N4O5/c1-3-17(2)26(22(28)16-31-15-18-8-5-4-6-9-18)13-12-21-24-23(25-32-21)19-10-7-11-20(14-19)27(29)30/h4-11,14,17H,3,12-13,15-16H2,1-2H3/t17-/m0/s1

InChI Key

BYVQAPOOOBSNOO-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD19780067

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

438.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.921

Distribution Coefficient, logD

4.921

Water Solubility, LogSw

-4.73

Polar Surface Area

88.388

Acid Dissociation Constant (pKa)

20.74

Base Dissociation Constant (pKb)

1.10

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.80

V029-3380 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 V029-3380 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-3380?
Check Price and Availability of V029-3380, 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 V029-3380 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-3380
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-3380
  • 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 V029-3380 available by request