8003-4887 Screening compound: N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-{[(4-nitrophenyl)methyl]sulfanyl}acetohydrazide

8003-4887 Screening compound: N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-{[(4-nitrophenyl)methyl]sulfanyl}acetohydrazide
8003-4887 Screening compound: N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-{[(4-nitrophenyl)methyl]sulfanyl}acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-4887
N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-{[(4-nitrophenyl)methyl]sulfanyl}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

8003-4887

Molecular Formula

C18H19N3O5S (C18 H19 N3 O5 S)

Compound Name

N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-{[(4-nitrophenyl)methyl]sulfanyl}acetohydrazide

IUPAC name

N'-[(E)-(25-dimethoxyphenyl)methylidene]-2-{[(4-nitrophenyl)methyl]sulfanyl}acetohydrazide

SMILES

COc(cc1)cc(/C=N/NC(CSCc(cc2)ccc2[N+]([O-])=O)=O)c1OC

InChI

InChI=1S/C18H19N3O5S/c1-25-16-7-8-17(26-2)14(9-16)10-19-20-18(22)12-27-11-13-3-5-15(6-4-13)21(23)24/h3-10H,11-12H2,1-2H3,(H,20,22)

InChI Key

ABIXYDWWNGTXSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00744094

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.826

Distribution Coefficient, logD

3.826

Water Solubility, LogSw

-4.08

Polar Surface Area

83.897

Acid Dissociation Constant (pKa)

10.64

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with 8003-4887 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-4887?
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What is the minimum amount of 8003-4887 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-4887
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-4887
  • 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 8003-4887 available by request