1679-1040 Screening compound: N'-[(E)-(5-nitrofuran-2-yl)methylidene]-2,2-diphenylcyclopropane-1-carbohydrazide

1679-1040 Screening compound: N'-[(E)-(5-nitrofuran-2-yl)methylidene]-2,2-diphenylcyclopropane-1-carbohydrazide
1679-1040 Screening compound: N'-[(E)-(5-nitrofuran-2-yl)methylidene]-2,2-diphenylcyclopropane-1-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1679-1040
N'-[(E)-(5-nitrofuran-2-yl)methylidene]-2,2-diphenylcyclopropane-1-carbohydrazide

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

1679-1040

Molecular Formula

C21H17N3O4 (C21 H17 N3 O4)

Compound Name

N'-[(E)-(5-nitrofuran-2-yl)methylidene]-2,2-diphenylcyclopropane-1-carbohydrazide

IUPAC name

N'-[(E)-(5-nitrofuran-2-yl)methylidene]-22-diphenylcyclopropane-1-carbohydrazide

SMILES

[O-][N+](c1ccc(/C=N/NC(C(C2)C2(c2ccccc2)c2ccccc2)=O)o1)=O

InChI

InChI=1S/C21H17N3O4/c25-20(23-22-14-17-11-12-19(28-17)24(26)27)18-13-21(18,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-12,14,18H,13H2,(H,23,25)/t18-/m1/s1

InChI Key

CGEUAFLHYZXMQN-GOSISDBHSA-N

MDL Number (MFCD)

MFCD00358076

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.38

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.398

Distribution Coefficient, logD

4.342

Water Solubility, LogSw

-4.45

Polar Surface Area

77.365

Acid Dissociation Constant (pKa)

8.26

Base Dissociation Constant (pKb)

0.47

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

14.30

1679-1040 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Protein-Protein Interaction Library (218420 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1679-1040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1679-1040?
Check Price and Availability of 1679-1040, 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 1679-1040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1679-1040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1679-1040
  • 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 1679-1040 available by request