2145-0076 Screening compound: 2-[(2E)-2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile

2145-0076 Screening compound: 2-[(2E)-2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
2145-0076 Screening compound: 2-[(2E)-2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 2145-0076
2-[(2E)-2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile

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

2145-0076

Molecular Formula

C16H14Br2N4O2 (C16 H14 Br2 N4 O2)

Compound Name

2-[(2E)-2-[(3,5-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile

IUPAC name

2-[(2E)-2-[(35-dibromo-2-hydroxyphenyl)methylidene]hydrazin-1-yl]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile

SMILES

Cc(nc1N/N=C/c2cc(Br)cc(Br)c2O)cc(COC)c1C#N

InChI

InChI=1S/C16H14Br2N4O2/c1-9-3-11(8-24-2)13(6-19)16(21-9)22-20-7-10-4-12(17)5-14(18)15(10)23/h3-5,7,23H,8H2,1-2H3,(H,21,22)

InChI Key

XWYJRHDRJOSLAW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01133349

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

454.12

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.407

Distribution Coefficient, logD

4.302

Water Solubility, LogSw

-4.22

Polar Surface Area

71.397

Acid Dissociation Constant (pKa)

7.96

Base Dissociation Constant (pKb)

1.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

2145-0076 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 2145-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2145-0076?
Check Price and Availability of 2145-0076, 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 2145-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2145-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2145-0076
  • 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 2145-0076 available by request