2038-0133 Screening compound: N'-[(E)-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylidene]-2-(9-oxo-9,10-dihydroacridin-10-yl)acetohydrazide

2038-0133 Screening compound: N'-[(E)-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylidene]-2-(9-oxo-9,10-dihydroacridin-10-yl)acetohydrazide
2038-0133 Screening compound: N'-[(E)-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylidene]-2-(9-oxo-9,10-dihydroacridin-10-yl)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2038-0133
N'-[(E)-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylidene]-2-(9-oxo-9,10-dihydroacridin-10-yl)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

2038-0133

Molecular Formula

C25H19BrN4O4 (C25 H19 BrN4 O4)

Compound Name

N'-[(E)-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylidene]-2-(9-oxo-9,10-dihydroacridin-10-yl)acetohydrazide

IUPAC name

N'-[(E)-[3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methylidene]-2-(9-oxo-910-dihydroacridin-10-yl)acetohydrazide

SMILES

COc1cc(/C=N/NC(CN(c2c3cccc2)c(cccc2)c2C3=O)=O)cc(Br)c1OCC#N

InChI

InChI=1S/C25H19BrN4O4/c1-33-22-13-16(12-19(26)25(22)34-11-10-27)14-28-29-23(31)15-30-20-8-4-2-6-17(20)24(32)18-7-3-5-9-21(18)30/h2-9,12-14H,11,15H2,1H3,(H,29,31)

InChI Key

HEIZMCUFOJKFQS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01160723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

519.35

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.587

Distribution Coefficient, logD

3.586

Water Solubility, LogSw

-4.09

Polar Surface Area

82.519

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

1.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.00

References: we are preparing a list of scientific research reports with 2038-0133 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2038-0133?
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What is the minimum amount of 2038-0133 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2038-0133
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2038-0133
  • 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 2038-0133 available by request