0672-0425 Screening compound: N'-[(1Z)-1-(4-hydroxy-2-oxo-2H-chromen-3-yl)ethylidene]-4-methylbenzene-1-sulfonohydrazide

0672-0425 Screening compound: N'-[(1Z)-1-(4-hydroxy-2-oxo-2H-chromen-3-yl)ethylidene]-4-methylbenzene-1-sulfonohydrazide
0672-0425 Screening compound: N'-[(1Z)-1-(4-hydroxy-2-oxo-2H-chromen-3-yl)ethylidene]-4-methylbenzene-1-sulfonohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0672-0425
N'-[(1Z)-1-(4-hydroxy-2-oxo-2H-chromen-3-yl)ethylidene]-4-methylbenzene-1-sulfonohydrazide

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

0672-0425

Molecular Formula

C18H16N2O5S (C18 H16 N2 O5 S)

Compound Name

N'-[(1Z)-1-(4-hydroxy-2-oxo-2H-chromen-3-yl)ethylidene]-4-methylbenzene-1-sulfonohydrazide

IUPAC name

N'-[(1Z)-1-(4-hydroxy-2-oxo-2H-chromen-3-yl)ethylidene]-4-methylbenzene-1-sulfonohydrazide

SMILES

C/C(/C(C(Oc1c2cccc1)=O)=C2O)=N/NS(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C18H16N2O5S/c1-11-7-9-13(10-8-11)26(23,24)20-19-12(2)16-17(21)14-5-3-4-6-15(14)25-18(16)22/h3-10,20-21H,1-2H3

InChI Key

YKSBUWWJPMTLKP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00990768

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.4

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.568

Distribution Coefficient, logD

-1.009

Water Solubility, LogSw

-3.26

Polar Surface Area

86.109

Acid Dissociation Constant (pKa)

3.82

Base Dissociation Constant (pKb)

-4.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

0672-0425 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 0672-0425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0672-0425?
Check Price and Availability of 0672-0425, 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 0672-0425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0672-0425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0672-0425
  • 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 0672-0425 available by request