K954-0007 Screening compound: 5-bromo-N-{4-[(Z)-N'-hydroxycarbamimidoyl]phenyl}furan-2-carboxamide

K954-0007 Screening compound: 5-bromo-N-{4-[(Z)-N'-hydroxycarbamimidoyl]phenyl}furan-2-carboxamide
K954-0007 Screening compound: 5-bromo-N-{4-[(Z)-N'-hydroxycarbamimidoyl]phenyl}furan-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K954-0007
5-bromo-N-{4-[(Z)-N'-hydroxycarbamimidoyl]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

K954-0007

Molecular Formula

C12H10BrN3O3 (C12 H10 BrN3 O3)

Compound Name

5-bromo-N-{4-[(Z)-N'-hydroxycarbamimidoyl]phenyl}furan-2-carboxamide

IUPAC name

5-bromo-N-{4-[(Z)-N'-hydroxycarbamimidoyl]phenyl}furan-2-carboxamide

SMILES

N/C(/c(cc1)ccc1NC(c(o1)ccc1Br)=O)=N\O

InChI

InChI=1S/C12H10BrN3O3/c13-10-6-5-9(19-10)12(17)15-8-3-1-7(2-4-8)11(14)16-18/h1-6,18H,(H2,14,16)(H,15,17)

InChI Key

HJUDSHUPJMTEHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03021202

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.13

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.777

Distribution Coefficient, logD

1.749

Water Solubility, LogSw

-2.34

Polar Surface Area

82.010

Acid Dissociation Constant (pKa)

8.64

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

K954-0007 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with K954-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K954-0007?
Check Price and Availability of K954-0007, 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 K954-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K954-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K954-0007
  • 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 K954-0007 available by request