0596-0026 Screening compound: (1E)-N1-[(3-nitrophenyl)methylidene]-4-phenyl-1H-imidazole-1,2-diamine

0596-0026 Screening compound: (1E)-N1-[(3-nitrophenyl)methylidene]-4-phenyl-1H-imidazole-1,2-diamine
0596-0026 Screening compound: (1E)-N1-[(3-nitrophenyl)methylidene]-4-phenyl-1H-imidazole-1,2-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 0596-0026
(1E)-N1-[(3-nitrophenyl)methylidene]-4-phenyl-1H-imidazole-1,2-diamine

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

0596-0026

Molecular Formula

C16H13N5O2 (C16 H13 N5 O2)

Compound Name

(1E)-N1-[(3-nitrophenyl)methylidene]-4-phenyl-1H-imidazole-1,2-diamine

IUPAC name

(1E)-N1-[(3-nitrophenyl)methylidene]-4-phenyl-1H-imidazole-12-diamine

SMILES

Nc1nc(-c2ccccc2)cn1/N=C/c1cccc([N+]([O-])=O)c1

InChI

InChI=1S/C16H13N5O2/c17-16-19-15(13-6-2-1-3-7-13)11-20(16)18-10-12-5-4-8-14(9-12)21(22)23/h1-11H,(H2,17,19)

InChI Key

FVSHRSDOCXNNGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01067621

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.31

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.998

Distribution Coefficient, logD

2.998

Water Solubility, LogSw

-3.34

Polar Surface Area

74.818

Acid Dissociation Constant (pKa)

21.89

Base Dissociation Constant (pKb)

4.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 0596-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0596-0026?
Check Price and Availability of 0596-0026, 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 0596-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0596-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0596-0026
  • 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 0596-0026 available by request