0154-0536 Screening compound: N'~2~-[(E)-1-(1,3-benzodioxol-5-yl)methylidene]-2-furohydrazide

0154-0536 Screening compound: N'~2~-[(E)-1-(1,3-benzodioxol-5-yl)methylidene]-2-furohydrazide
0154-0536 Screening compound: N'~2~-[(E)-1-(1,3-benzodioxol-5-yl)methylidene]-2-furohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0154-0536
N'~2~-[(E)-1-(1,3-benzodioxol-5-yl)methylidene]-2-furohydrazide

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

0154-0536

Molecular Formula

C13H10N2O4 (C13 H10 N2 O4)

Compound Name

N'~2~-[(E)-1-(1,3-benzodioxol-5-yl)methylidene]-2-furohydrazide

IUPAC name

N'-[(E)-(2H-13-benzodioxol-5-yl)methylidene]furan-2-carbohydrazide

SMILES

O=C(c1ccco1)N/N=C/c(cc1)cc2c1OCO2

InChI

InChI=1S/C13H10N2O4/c16-13(11-2-1-5-17-11)15-14-7-9-3-4-10-12(6-9)19-8-18-10/h1-7H,8H2,(H,15,16)

InChI Key

KQBUMZVZZXMZPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00436928

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.23

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.251

Distribution Coefficient, logD

2.249

Water Solubility, LogSw

-2.87

Polar Surface Area

61.248

Acid Dissociation Constant (pKa)

9.86

Base Dissociation Constant (pKb)

3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.69

0154-0536 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0154-0536 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0154-0536?
Check Price and Availability of 0154-0536, 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 0154-0536 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0154-0536
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0154-0536
  • 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 0154-0536 available by request