5408-1981 Screening compound: N'-[(E)-(pyridin-3-yl)methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide

5408-1981 Screening compound: N'-[(E)-(pyridin-3-yl)methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide
5408-1981 Screening compound: N'-[(E)-(pyridin-3-yl)methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5408-1981
N'-[(E)-(pyridin-3-yl)methylidene]-2-(pyrimidin-2-ylsulfanyl)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

5408-1981

Molecular Formula

C12H11N5OS (C12 H11 N5 OS)

Compound Name

N'-[(E)-(pyridin-3-yl)methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide

IUPAC name

N'-[(E)-(pyridin-3-yl)methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide

SMILES

O=C(CSc1ncccn1)N/N=C/c1cnccc1

InChI

InChI=1S/C12H11N5OS/c18-11(9-19-12-14-5-2-6-15-12)17-16-8-10-3-1-4-13-7-10/h1-8H,9H2,(H,17,18)

InChI Key

IOCCWLYZCPZLLM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827329

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

273.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.725

Distribution Coefficient, logD

0.724

Water Solubility, LogSw

-1.57

Polar Surface Area

63.016

Acid Dissociation Constant (pKa)

10.31

Base Dissociation Constant (pKb)

2.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

References: we are preparing a list of scientific research reports with 5408-1981 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5408-1981?
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What is the minimum amount of 5408-1981 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5408-1981
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5408-1981
  • 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 5408-1981 available by request