8007-0247 Screening compound: N'-[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]-2-(naphthalen-1-yl)acetohydrazide

8007-0247 Screening compound: N'-[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]-2-(naphthalen-1-yl)acetohydrazide
8007-0247 Screening compound: N'-[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]-2-(naphthalen-1-yl)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-0247
N'-[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]-2-(naphthalen-1-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

8007-0247

Molecular Formula

C23H19N5O3S (C23 H19 N5 O3 S)

Compound Name

N'-[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]-2-(naphthalen-1-yl)acetohydrazide

IUPAC name

N'-[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]-2-(naphthalen-1-yl)acetohydrazide

SMILES

Cn1c(Sc(ccc(/C=N/NC(Cc2cccc3ccccc23)=O)c2)c2[N+]([O-])=O)ncc1

InChI

InChI=1S/C23H19N5O3S/c1-27-12-11-24-23(27)32-21-10-9-16(13-20(21)28(30)31)15-25-26-22(29)14-18-7-4-6-17-5-2-3-8-19(17)18/h2-13,15H,14H2,1H3,(H,26,29)

InChI Key

XJACNKGMXHQOEN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00762005

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.770

Distribution Coefficient, logD

4.765

Water Solubility, LogSw

-5.23

Polar Surface Area

80.797

Acid Dissociation Constant (pKa)

9.81

Base Dissociation Constant (pKb)

5.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

8007-0247 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 8007-0247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-0247?
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What is the minimum amount of 8007-0247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-0247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-0247
  • 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 8007-0247 available by request