3272-1074 Screening compound: 2-{[(4-methylphenyl)methyl]sulfanyl}-N'-[(E)-[3-(thietan-3-yloxy)phenyl]methylidene]acetohydrazide

3272-1074 Screening compound: 2-{[(4-methylphenyl)methyl]sulfanyl}-N'-[(E)-[3-(thietan-3-yloxy)phenyl]methylidene]acetohydrazide
3272-1074 Screening compound: 2-{[(4-methylphenyl)methyl]sulfanyl}-N'-[(E)-[3-(thietan-3-yloxy)phenyl]methylidene]acetohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3272-1074
2-{[(4-methylphenyl)methyl]sulfanyl}-N'-[(E)-[3-(thietan-3-yloxy)phenyl]methylidene]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

3272-1074

Molecular Formula

C20H22N2O2S2 (C20 H22 N2 O2 S2)

Compound Name

2-{[(4-methylphenyl)methyl]sulfanyl}-N'-[(E)-[3-(thietan-3-yloxy)phenyl]methylidene]acetohydrazide

IUPAC name

2-{[(4-methylphenyl)methyl]sulfanyl}-N'-[(E)-[3-(thietan-3-yloxy)phenyl]methylidene]acetohydrazide

SMILES

Cc1ccc(CSCC(N/N=C/c2cccc(OC3CSC3)c2)=O)cc1

InChI

InChI=1S/C20H22N2O2S2/c1-15-5-7-16(8-6-15)11-25-14-20(23)22-21-10-17-3-2-4-18(9-17)24-19-12-26-13-19/h2-10,19H,11-14H2,1H3,(H,22,23)

InChI Key

ZHNXASXOLTYBHU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01873930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.302

Distribution Coefficient, logD

4.301

Water Solubility, LogSw

-4.27

Polar Surface Area

42.126

Acid Dissociation Constant (pKa)

10.03

Base Dissociation Constant (pKb)

0.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

3272-1074 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 3272-1074 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 3272-1074 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3272-1074
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3272-1074
  • 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 3272-1074 available by request