3253-4590 Screening compound: N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide

3253-4590 Screening compound: N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide
3253-4590 Screening compound: N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3253-4590
N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)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

3253-4590

Molecular Formula

C17H14Cl2N4OS (C17 H14 Cl2 N4 OS)

Compound Name

N'-[(E)-(3,4-dichlorophenyl)methylidene]-2-[(1-methyl-1H-1,3-benzodiazol-2-yl)sulfanyl]acetohydrazide

IUPAC name

N'-[(E)-(34-dichlorophenyl)methylidene]-2-[(1-methyl-1H-13-benzodiazol-2-yl)sulfanyl]acetohydrazide

SMILES

Cn1c(SCC(N/N=C/c(cc2)cc(Cl)c2Cl)=O)nc2c1cccc2

InChI

InChI=1S/C17H14Cl2N4OS/c1-23-15-5-3-2-4-14(15)21-17(23)25-10-16(24)22-20-9-11-6-7-12(18)13(19)8-11/h2-9H,10H2,1H3,(H,22,24)

InChI Key

VHHKVHYNFXDTAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01914279

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.786

Distribution Coefficient, logD

4.780

Water Solubility, LogSw

-4.97

Polar Surface Area

46.933

Acid Dissociation Constant (pKa)

9.78

Base Dissociation Constant (pKb)

5.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

References: we are preparing a list of scientific research reports with 3253-4590 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3253-4590?
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What is the minimum amount of 3253-4590 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3253-4590
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3253-4590
  • 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 3253-4590 available by request