5408-1956 Screening compound: N'-[(E)-[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide

5408-1956 Screening compound: N'-[(E)-[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide
5408-1956 Screening compound: N'-[(E)-[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5408-1956
N'-[(E)-[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-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

5408-1956

Molecular Formula

C19H18ClN5OS (C19 H18 ClN5 OS)

Compound Name

N'-[(E)-[1-(2-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide

IUPAC name

N'-[(E)-[1-(2-chlorophenyl)-25-dimethyl-1H-pyrrol-3-yl]methylidene]-2-(pyrimidin-2-ylsulfanyl)acetohydrazide

SMILES

Cc1cc(/C=N/NC(CSc2ncccn2)=O)c(C)n1-c(cccc1)c1Cl

InChI

InChI=1S/C19H18ClN5OS/c1-13-10-15(14(2)25(13)17-7-4-3-6-16(17)20)11-23-24-18(26)12-27-19-21-8-5-9-22-19/h3-11H,12H2,1-2H3,(H,24,26)

InChI Key

WKNOXGCLKUAVGK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.9

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.192

Distribution Coefficient, logD

3.192

Water Solubility, LogSw

-3.38

Polar Surface Area

55.862

Acid Dissociation Constant (pKa)

11.17

Base Dissociation Constant (pKb)

1.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

References: we are preparing a list of scientific research reports with 5408-1956 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5408-1956?
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What is the minimum amount of 5408-1956 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5408-1956
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5408-1956
  • 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 5408-1956 available by request