8003-8460 Screening compound: N'~1~-[(E)-1-(2-methyl-5-nitrophenyl)methylidene]-2-[(2-methylphenyl)sulfanyl]acetohydrazide

8003-8460 Screening compound: N'~1~-[(E)-1-(2-methyl-5-nitrophenyl)methylidene]-2-[(2-methylphenyl)sulfanyl]acetohydrazide
8003-8460 Screening compound: N'~1~-[(E)-1-(2-methyl-5-nitrophenyl)methylidene]-2-[(2-methylphenyl)sulfanyl]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-8460
N'~1~-[(E)-1-(2-methyl-5-nitrophenyl)methylidene]-2-[(2-methylphenyl)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

8003-8460

Molecular Formula

C17H17N3O3S (C17 H17 N3 O3 S)

Compound Name

N'~1~-[(E)-1-(2-methyl-5-nitrophenyl)methylidene]-2-[(2-methylphenyl)sulfanyl]acetohydrazide

IUPAC name

N'-[(E)-(2-methyl-5-nitrophenyl)methylidene]-2-[(2-methylphenyl)sulfanyl]acetohydrazide

SMILES

Cc(cc1)c(/C=N/NC(CSc2c(C)cccc2)=O)cc1[N+]([O-])=O

InChI

InChI=1S/C17H17N3O3S/c1-12-7-8-15(20(22)23)9-14(12)10-18-19-17(21)11-24-16-6-4-3-5-13(16)2/h3-10H,11H2,1-2H3,(H,19,21)

InChI Key

ICHLONKYWZCSOD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00384574

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.313

Distribution Coefficient, logD

4.311

Water Solubility, LogSw

-4.26

Polar Surface Area

68.722

Acid Dissociation Constant (pKa)

9.85

Base Dissociation Constant (pKb)

0.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.65

References: we are preparing a list of scientific research reports with 8003-8460 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-8460?
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What is the minimum amount of 8003-8460 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-8460
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-8460
  • 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 8003-8460 available by request