3272-0859 Screening compound: N'-[(E)-(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-(phenylsulfanyl)propanehydrazide

3272-0859 Screening compound: N'-[(E)-(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-(phenylsulfanyl)propanehydrazide
3272-0859 Screening compound: N'-[(E)-(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-(phenylsulfanyl)propanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3272-0859
N'-[(E)-(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-(phenylsulfanyl)propanehydrazide

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

3272-0859

Molecular Formula

C17H15BrN2O3S (C17 H15 BrN2 O3 S)

Compound Name

N'-[(E)-(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]-3-(phenylsulfanyl)propanehydrazide

IUPAC name

N'-[(E)-(6-bromo-2H-13-benzodioxol-5-yl)methylidene]-3-(phenylsulfanyl)propanehydrazide

SMILES

O=C(CCSc1ccccc1)N/N=C/c(cc1OCOc1c1)c1Br

InChI

InChI=1S/C17H15BrN2O3S/c18-14-9-16-15(22-11-23-16)8-12(14)10-19-20-17(21)6-7-24-13-4-2-1-3-5-13/h1-5,8-10H,6-7,11H2,(H,20,21)

InChI Key

PHWPSBYXFSGRDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01120331

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.29

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.132

Distribution Coefficient, logD

4.128

Water Solubility, LogSw

-4.28

Polar Surface Area

52.456

Acid Dissociation Constant (pKa)

9.49

Base Dissociation Constant (pKb)

0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with 3272-0859 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3272-0859?
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What is the minimum amount of 3272-0859 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3272-0859
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3272-0859
  • 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 3272-0859 available by request