8010-6567 Screening compound: (Z)-4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide

8010-6567 Screening compound: (Z)-4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide
8010-6567 Screening compound: (Z)-4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-6567
(Z)-4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide

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

8010-6567

Molecular Formula

C11H12ClN7O4 (C11 H12 ClN7 O4)

Compound Name

(Z)-4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-N'-hydroxy-1,2,5-oxadiazole-3-carboximidamide

IUPAC name

(Z)-4-amino-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}-N'-hydroxy-125-oxadiazole-3-carboximidamide

SMILES

Nc1nonc1/C(/NCCNc(ccc([N+]([O-])=O)c1)c1Cl)=N/O

InChI

InChI=1S/C11H12ClN7O4/c12-7-5-6(19(21)22)1-2-8(7)14-3-4-15-11(16-20)9-10(13)18-23-17-9/h1-2,5,14,20H,3-4H2,(H2,13,18)(H,15,16)

InChI Key

KAZNLVCHZBPZOS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00785195

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.71

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

1.311

Distribution Coefficient, logD

1.307

Water Solubility, LogSw

-2.44

Polar Surface Area

140.225

Acid Dissociation Constant (pKa)

9.38

Base Dissociation Constant (pKb)

2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

8010-6567 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 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 8010-6567 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-6567?
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What is the minimum amount of 8010-6567 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-6567
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-6567
  • 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 8010-6567 available by request