3254-2961 Screening compound: N'-[(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene]-2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetohydrazide

3254-2961 Screening compound: N'-[(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene]-2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetohydrazide
3254-2961 Screening compound: N'-[(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene]-2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3254-2961
N'-[(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene]-2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-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

3254-2961

Molecular Formula

C26H24N4O3S3 (C26 H24 N4 O3 S3)

Compound Name

N'-[(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene]-2-{[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetohydrazide

IUPAC name

N'-[(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene]-2-{[5-(benzylsulfanyl)-134-thiadiazol-2-yl]sulfanyl}acetohydrazide

SMILES

COc(cc(/C=N/NC(CSc1nnc(SCc2ccccc2)s1)=O)cc1)c1OCc1ccccc1

InChI

InChI=1S/C26H24N4O3S3/c1-32-23-14-21(12-13-22(23)33-16-19-8-4-2-5-9-19)15-27-28-24(31)18-35-26-30-29-25(36-26)34-17-20-10-6-3-7-11-20/h2-15H,16-18H2,1H3,(H,28,31)

InChI Key

BHKXTTPKRROHJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02075631

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

536.7

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.393

Distribution Coefficient, logD

5.392

Water Solubility, LogSw

-5.46

Polar Surface Area

72.240

Acid Dissociation Constant (pKa)

11.00

Base Dissociation Constant (pKb)

1.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

References: we are preparing a list of scientific research reports with 3254-2961 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3254-2961?
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What is the minimum amount of 3254-2961 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3254-2961
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3254-2961
  • 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 3254-2961 available by request