8018-8496 Screening compound: (Z)-4-amino-N'-hydroxy-N-[(4-methoxyphenyl)methyl]-1,2,5-oxadiazole-3-carboximidamide

8018-8496 Screening compound: (Z)-4-amino-N'-hydroxy-N-[(4-methoxyphenyl)methyl]-1,2,5-oxadiazole-3-carboximidamide
8018-8496 Screening compound: (Z)-4-amino-N'-hydroxy-N-[(4-methoxyphenyl)methyl]-1,2,5-oxadiazole-3-carboximidamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8496
(Z)-4-amino-N'-hydroxy-N-[(4-methoxyphenyl)methyl]-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

8018-8496

Molecular Formula

C11H13N5O3 (C11 H13 N5 O3)

Compound Name

(Z)-4-amino-N'-hydroxy-N-[(4-methoxyphenyl)methyl]-1,2,5-oxadiazole-3-carboximidamide

IUPAC name

(Z)-4-amino-N'-hydroxy-N-[(4-methoxyphenyl)methyl]-125-oxadiazole-3-carboximidamide

SMILES

COc1ccc(CN/C(/c2nonc2N)=N\O)cc1

InChI

InChI=1S/C11H13N5O3/c1-18-8-4-2-7(3-5-8)6-13-11(14-17)9-10(12)16-19-15-9/h2-5,17H,6H2,1H3,(H2,12,16)(H,13,14)

InChI Key

RANWSJMGTBUZGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09062800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

263.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.728

Distribution Coefficient, logD

0.723

Water Solubility, LogSw

-1.66

Polar Surface Area

104.895

Acid Dissociation Constant (pKa)

9.36

Base Dissociation Constant (pKb)

2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

8018-8496 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8018-8496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8496?
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What is the minimum amount of 8018-8496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8496
  • 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 8018-8496 available by request