0716-0005 Screening compound: N-[(2E,5E)-2,5-bis[(phenylamino)methylidene]cyclopentylidene]-N-phenylanilinium

0716-0005 Screening compound: N-[(2E,5E)-2,5-bis[(phenylamino)methylidene]cyclopentylidene]-N-phenylanilinium
0716-0005 Screening compound: N-[(2E,5E)-2,5-bis[(phenylamino)methylidene]cyclopentylidene]-N-phenylanilinium alternative view

Chemical Structure Depiction of ChemDiv screening compound 0716-0005
N-[(2E,5E)-2,5-bis[(phenylamino)methylidene]cyclopentylidene]-N-phenylanilinium

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

0716-0005

Molecular Formula

C31H28N3 (C31 H28 N3)

Compound Name

N-[(2E,5E)-2,5-bis[(phenylamino)methylidene]cyclopentylidene]-N-phenylanilinium

IUPAC name

N-[(2E5E)-25-bis[(phenylamino)methylidene]cyclopentylidene]-N-phenylanilinium

SMILES

C(C/C(/C1=[N+](c2ccccc2)c2ccccc2)=C\Nc2ccccc2)/C1=C\Nc1ccccc1

InChI

InChI=1S/C31H27N3/c1-5-13-27(14-6-1)32-23-25-21-22-26(24-33-28-15-7-2-8-16-28)31(25)34(29-17-9-3-10-18-29)30-19-11-4-12-20-30/h1-20,23-24H,21-22H2,(H,32,33)/p+1

InChI Key

PQRRQTAWFLEQOR-UHFFFAOYSA-O

MDL Number (MFCD)

MFCD00805966

Chemical and Physical Properties

Saltdata

ClO4-

Molecular Weight

442.58

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

7.151

Distribution Coefficient, logD

7.151

Water Solubility, LogSw

-6.34

Polar Surface Area

25.303

Acid Dissociation Constant (pKa)

14.89

Base Dissociation Constant (pKb)

3.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.50

References: we are preparing a list of scientific research reports with 0716-0005 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0716-0005?
Check Price and Availability of 0716-0005, 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 0716-0005 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0716-0005
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0716-0005
  • 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 0716-0005 available by request