0262-0300 Screening compound: 1lambda~6~,7lambda~6~-isothiazolo[4,5-f][1,2]benzisothiazole-1,1,3,5,7,7(2H,6H)-hexaone

0262-0300 Screening compound: 1lambda~6~,7lambda~6~-isothiazolo[4,5-f][1,2]benzisothiazole-1,1,3,5,7,7(2H,6H)-hexaone
0262-0300 Screening compound: 1lambda~6~,7lambda~6~-isothiazolo[4,5-f][1,2]benzisothiazole-1,1,3,5,7,7(2H,6H)-hexaone alternative view

Chemical Structure Depiction of ChemDiv screening compound 0262-0300
1lambda~6~,7lambda~6~-isothiazolo[4,5-f][1,2]benzisothiazole-1,1,3,5,7,7(2H,6H)-hexaone

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

0262-0300

Molecular Formula

C8H4N2O6S2 (C8 H4 N2 O6 S2)

Compound Name

1lambda~6~,7lambda~6~-isothiazolo[4,5-f][1,2]benzisothiazole-1,1,3,5,7,7(2H,6H)-hexaone

IUPAC name

4lambda612lambda6-dithia-511-diazatricyclo[7.3.0.0^{37}]dodeca-13(7)8-triene-446101212-hexone

SMILES

O=C(c(c1c2)cc(C(N3)=O)c2S3(=O)=O)NS1(=O)=O

InChI

InChI=1S/C8H4N2O6S2/c11-7-3-1-4-6(18(15,16)10-8(4)12)2-5(3)17(13,14)9-7/h1-2H,(H,9,11)(H,10,12)

InChI Key

ZYPHNTFDOHGNDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00625705

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.26

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.868

Distribution Coefficient, logD

-7.382

Water Solubility, LogSw

-1.80

Polar Surface Area

109.217

Acid Dissociation Constant (pKa)

0.89

Base Dissociation Constant (pKb)

-18.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0262-0300 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0262-0300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0262-0300?
Check Price and Availability of 0262-0300, 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 0262-0300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0262-0300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0262-0300
  • 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 0262-0300 available by request