V030-3894 Screening compound: N-{2-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide

V030-3894 Screening compound: N-{2-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide
V030-3894 Screening compound: N-{2-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]ethyl}-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-3894
N-{2-[3-(furan-2-yl)-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

V030-3894

Molecular Formula

C15H12N4O5 (C15 H12 N4 O5)

Compound Name

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

IUPAC name

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

SMILES

[O-][N+](c1cc(C(NCCc2nc(-c3ccco3)no2)=O)ccc1)=O

InChI

InChI=1S/C15H12N4O5/c20-15(10-3-1-4-11(9-10)19(21)22)16-7-6-13-17-14(18-24-13)12-5-2-8-23-12/h1-5,8-9H,6-7H2,(H,16,20)

InChI Key

FCWMEFBAPZEGCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20494140

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

328.28

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.035

Distribution Coefficient, logD

2.035

Water Solubility, LogSw

-2.62

Polar Surface Area

97.796

Acid Dissociation Constant (pKa)

12.40

Base Dissociation Constant (pKb)

-3.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

V030-3894 in Drug Discovery

Included in Screening Libraries

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

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with V030-3894 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-3894?
Check Price and Availability of V030-3894, 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 V030-3894 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-3894
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-3894
  • 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 V030-3894 available by request