2145-0252 Screening compound: 2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]acetohydrazide

2145-0252 Screening compound: 2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]acetohydrazide
2145-0252 Screening compound: 2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2145-0252
2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]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

2145-0252

Molecular Formula

C22H22Br2N4O5 (C22 H22 Br2 N4 O5)

Compound Name

2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]acetohydrazide

IUPAC name

2-{[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}-N'-[(E)-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]methylidene]acetohydrazide

SMILES

Cc(c(Br)c1COC)nc(OCC(N/N=C/c(cc2OC)cc(Br)c2OCC=C)=O)c1C#N

InChI

InChI=1S/C22H22Br2N4O5/c1-5-6-32-21-17(23)7-14(8-18(21)31-4)10-26-28-19(29)12-33-22-15(9-25)16(11-30-3)20(24)13(2)27-22/h5,7-8,10H,1,6,11-12H2,2-4H3,(H,28,29)

InChI Key

BROQVSMIPLSQLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01133579

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

582.25

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.209

Distribution Coefficient, logD

4.208

Water Solubility, LogSw

-4.44

Polar Surface Area

93.492

Acid Dissociation Constant (pKa)

10.01

Base Dissociation Constant (pKb)

2.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

References: we are preparing a list of scientific research reports with 2145-0252 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2145-0252?
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What is the minimum amount of 2145-0252 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2145-0252
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2145-0252
  • 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 2145-0252 available by request