0960-0087 Screening compound: N-{3-[(E)-({5-[(1Z)-2-(2-chlorophenyl)diazen-1-yl]-2-hydroxyphenyl}methylidene)amino]phenyl}furan-2-carboxamide

0960-0087 Screening compound: N-{3-[(E)-({5-[(1Z)-2-(2-chlorophenyl)diazen-1-yl]-2-hydroxyphenyl}methylidene)amino]phenyl}furan-2-carboxamide
0960-0087 Screening compound: N-{3-[(E)-({5-[(1Z)-2-(2-chlorophenyl)diazen-1-yl]-2-hydroxyphenyl}methylidene)amino]phenyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0960-0087
N-{3-[(E)-({5-[(1Z)-2-(2-chlorophenyl)diazen-1-yl]-2-hydroxyphenyl}methylidene)amino]phenyl}furan-2-carboxamide

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

0960-0087

Molecular Formula

C24H17ClN4O3 (C24 H17 ClN4 O3)

Compound Name

N-{3-[(E)-({5-[(1Z)-2-(2-chlorophenyl)diazen-1-yl]-2-hydroxyphenyl}methylidene)amino]phenyl}furan-2-carboxamide

IUPAC name

N-{3-[(E)-({5-[(1Z)-2-(2-chlorophenyl)diazen-1-yl]-2-hydroxyphenyl}methylidene)amino]phenyl}furan-2-carboxamide

SMILES

Oc(cc1)c(/C=N/c2cc(NC(c3ccco3)=O)ccc2)cc1/N=N\c(cccc1)c1Cl

InChI

InChI=1S/C24H17ClN4O3/c25-20-7-1-2-8-21(20)29-28-19-10-11-22(30)16(13-19)15-26-17-5-3-6-18(14-17)27-24(31)23-9-4-12-32-23/h1-15,30H,(H,27,31)

InChI Key

KBCYZVZQYZBOBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01536232

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.88

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

6.095

Distribution Coefficient, logD

6.062

Water Solubility, LogSw

-5.84

Polar Surface Area

77.573

Acid Dissociation Constant (pKa)

8.51

Base Dissociation Constant (pKb)

0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0960-0087 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0960-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0960-0087?
Check Price and Availability of 0960-0087, 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 0960-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0960-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0960-0087
  • 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 0960-0087 available by request