G786-0333 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide

G786-0333 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide
G786-0333 Screening compound: N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-0333
N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide

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

G786-0333

Molecular Formula

C17H15N3O3S (C17 H15 N3 O3 S)

Compound Name

N'-[(2E)-3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]-2,3-dihydro-1,4-benzodioxine-6-carbohydrazide

IUPAC name

N'-[(2E)-3-methyl-23-dihydro-13-benzothiazol-2-ylidene]-23-dihydro-14-benzodioxine-6-carbohydrazide

SMILES

CN(c(cccc1)c1S1)/C1=N\NC(c(cc1)cc2c1OCCO2)=O

InChI

InChI=1S/C17H15N3O3S/c1-20-12-4-2-3-5-15(12)24-17(20)19-18-16(21)11-6-7-13-14(10-11)23-9-8-22-13/h2-7,10H,8-9H2,1H3,(H,18,21)

InChI Key

WDNPBFNWEJBHEC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04420795

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.245

Distribution Coefficient, logD

2.244

Water Solubility, LogSw

-2.88

Polar Surface Area

54.087

Acid Dissociation Constant (pKa)

10.15

Base Dissociation Constant (pKb)

-1.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

References: we are preparing a list of scientific research reports with G786-0333 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-0333?
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What is the minimum amount of G786-0333 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-0333
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-0333
  • 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 G786-0333 available by request