1771-0060 Screening compound: 2-[(E)-[2-(1H-1,3-benzodiazol-2-yl)hydrazin-1-ylidene]methyl]-6-nitrophenol

1771-0060 Screening compound: 2-[(E)-[2-(1H-1,3-benzodiazol-2-yl)hydrazin-1-ylidene]methyl]-6-nitrophenol
1771-0060 Screening compound: 2-[(E)-[2-(1H-1,3-benzodiazol-2-yl)hydrazin-1-ylidene]methyl]-6-nitrophenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 1771-0060
2-[(E)-[2-(1H-1,3-benzodiazol-2-yl)hydrazin-1-ylidene]methyl]-6-nitrophenol

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

1771-0060

Molecular Formula

C14H11N5O3 (C14 H11 N5 O3)

Compound Name

2-[(E)-[2-(1H-1,3-benzodiazol-2-yl)hydrazin-1-ylidene]methyl]-6-nitrophenol

IUPAC name

2-[(E)-[2-(1H-13-benzodiazol-2-yl)hydrazin-1-ylidene]methyl]-6-nitrophenol

SMILES

[O-][N+](c(cccc1/C=N/Nc2nc(cccc3)c3[nH]2)c1O)=O

InChI

InChI=1S/C14H11N5O3/c20-13-9(4-3-7-12(13)19(21)22)8-15-18-14-16-10-5-1-2-6-11(10)17-14/h1-8,20H,(H2,16,17,18)

InChI Key

VHMQWIUCGJAVDL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01247066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.144

Distribution Coefficient, logD

2.210

Water Solubility, LogSw

-3.30

Polar Surface Area

90.360

Acid Dissociation Constant (pKa)

6.52

Base Dissociation Constant (pKb)

6.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1771-0060 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 1771-0060 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1771-0060?
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What is the minimum amount of 1771-0060 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1771-0060
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1771-0060
  • 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 1771-0060 available by request