8008-1942 Screening compound: 2-[(2,4-dichlorobenzyl)oxy]benzaldehyde 1-{6-[(2-oxo-2,3-dihydro-1H-1,3-benzimidazol-5-yl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazone

8008-1942 Screening compound: 2-[(2,4-dichlorobenzyl)oxy]benzaldehyde 1-{6-[(2-oxo-2,3-dihydro-1H-1,3-benzimidazol-5-yl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazone
8008-1942 Screening compound: 2-[(2,4-dichlorobenzyl)oxy]benzaldehyde 1-{6-[(2-oxo-2,3-dihydro-1H-1,3-benzimidazol-5-yl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-1942
2-[(2,4-dichlorobenzyl)oxy]benzaldehyde 1-{6-[(2-oxo-2,3-dihydro-1H-1,3-benzimidazol-5-yl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazone

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

8008-1942

Molecular Formula

C25H17Cl2N9O3 (C25 H17 Cl2 N9 O3)

Compound Name

2-[(2,4-dichlorobenzyl)oxy]benzaldehyde 1-{6-[(2-oxo-2,3-dihydro-1H-1,3-benzimidazol-5-yl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazone

IUPAC name

5-({6-[(2E)-2-({2-[(24-dichlorophenyl)methoxy]phenyl}methylidene)hydrazin-1-yl]-[125]oxadiazolo[34-b]pyrazin-5-yl}amino)-23-dihydro-1H-13-benzodiazol-2-one

SMILES

O=C1Nc(cc(cc2)Nc3nc4nonc4nc3N/N=C/c(cccc3)c3OCc(ccc(Cl)c3)c3Cl)c2N1

InChI

InChI=1S/C25H17Cl2N9O3/c26-15-6-5-14(17(27)9-15)12-38-20-4-2-1-3-13(20)11-28-34-22-21(32-23-24(33-22)36-39-35-23)29-16-7-8-18-19(10-16)31-25(37)30-18/h1-11H,12H2,(H,29,32,35)(H2,30,31,37)(H,33,34,36)

InChI Key

GRAURRRKTOOHJA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01065939

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

562.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

6.848

Distribution Coefficient, logD

6.848

Water Solubility, LogSw

-6.53

Polar Surface Area

129.812

Acid Dissociation Constant (pKa)

12.23

Base Dissociation Constant (pKb)

3.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

References: we are preparing a list of scientific research reports with 8008-1942 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-1942?
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What is the minimum amount of 8008-1942 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-1942
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-1942
  • 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 8008-1942 available by request