1123-0017 Screening compound: 4-[(E)-[(4-nitrophenyl)methylidene]amino]phenol

1123-0017 Screening compound: 4-[(E)-[(4-nitrophenyl)methylidene]amino]phenol
1123-0017 Screening compound: 4-[(E)-[(4-nitrophenyl)methylidene]amino]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1123-0017
4-[(E)-[(4-nitrophenyl)methylidene]amino]phenol

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

1123-0017

Molecular Formula

C13H10N2O3 (C13 H10 N2 O3)

Compound Name

4-[(E)-[(4-nitrophenyl)methylidene]amino]phenol

IUPAC name

4-[(E)-[(4-nitrophenyl)methylidene]amino]phenol

SMILES

[O-][N+](c1ccc(/C=N/c(cc2)ccc2O)cc1)=O

InChI

InChI=1S/C13H10N2O3/c16-13-7-3-11(4-8-13)14-9-10-1-5-12(6-2-10)15(17)18/h1-9,16H

InChI Key

SLHOVHNNONKHGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00446826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

242.23

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.486

Distribution Coefficient, logD

2.482

Water Solubility, LogSw

-2.16

Polar Surface Area

59.364

Acid Dissociation Constant (pKa)

9.49

Base Dissociation Constant (pKb)

4.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1123-0017 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1123-0017 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1123-0017?
Check Price and Availability of 1123-0017, 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 1123-0017 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1123-0017
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1123-0017
  • 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 1123-0017 available by request