2145-0312 Screening compound: 2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[5-(4-iodophenyl)furan-2-yl]methylidene]acetohydrazide

2145-0312 Screening compound: 2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[5-(4-iodophenyl)furan-2-yl]methylidene]acetohydrazide
2145-0312 Screening compound: 2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[5-(4-iodophenyl)furan-2-yl]methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2145-0312
2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[5-(4-iodophenyl)furan-2-yl]methylidene]acetohydrazide

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

2145-0312

Molecular Formula

C22H18BrIN4O4 (C22 H18 BrIN4 O4)

Compound Name

2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[5-(4-iodophenyl)furan-2-yl]methylidene]acetohydrazide

IUPAC name

2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[5-(4-iodophenyl)furan-2-yl]methylidene]acetohydrazide

SMILES

Cc(nc(c(C#N)c1COC)OCC(N/N=C/c2ccc(-c(cc3)ccc3I)o2)=O)c1Br

InChI

InChI=1S/C22H18BrIN4O4/c1-13-21(23)18(11-30-2)17(9-25)22(27-13)31-12-20(29)28-26-10-16-7-8-19(32-16)14-3-5-15(24)6-4-14/h3-8,10H,11-12H2,1-2H3,(H,28,29)

InChI Key

KWBXEQRWTBHUHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01133639

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

609.22

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.672

Distribution Coefficient, logD

5.672

Water Solubility, LogSw

-5.63

Polar Surface Area

85.840

Acid Dissociation Constant (pKa)

11.65

Base Dissociation Constant (pKb)

1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with 2145-0312 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2145-0312?
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What is the minimum amount of 2145-0312 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2145-0312
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2145-0312
  • 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 2145-0312 available by request