2652-0239 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]propanehydrazide

2652-0239 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]propanehydrazide
2652-0239 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]propanehydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2652-0239
N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]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

2652-0239

Molecular Formula

C11H13N3OS (C11 H13 N3 OS)

Compound Name

N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]propanehydrazide

IUPAC name

N'-[(2E)-3-methyl-23-dihydro-13-benzothiazol-2-ylidene]propanehydrazide

SMILES

CCC(N/N=C1/Sc(cccc2)c2N1C)=O

InChI

InChI=1S/C11H13N3OS/c1-3-10(15)12-13-11-14(2)8-6-4-5-7-9(8)16-11/h4-7H,3H2,1-2H3,(H,12,15)

InChI Key

YXJIJCVMXKNMNV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01932507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

235.31

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.125

Distribution Coefficient, logD

2.125

Water Solubility, LogSw

-2.57

Polar Surface Area

38.322

Acid Dissociation Constant (pKa)

10.75

Base Dissociation Constant (pKb)

0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

2652-0239 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 2652-0239 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2652-0239?
Check Price and Availability of 2652-0239, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 2652-0239 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2652-0239
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2652-0239
  • 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 2652-0239 available by request