0108-0030 Screening compound: 3,7-diamino-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione

0108-0030 Screening compound: 3,7-diamino-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione
0108-0030 Screening compound: 3,7-diamino-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0108-0030
3,7-diamino-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione

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

0108-0030

Molecular Formula

C12H10N2O2S (C12 H10 N2 O2 S)

Compound Name

3,7-diamino-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione

IUPAC name

511-diamino-8lambda6-thiatricyclo[7.4.0.0^{27}]trideca-1(9)2(7)351012-hexaene-88-dione

SMILES

Nc(cc1)cc2c1-c(ccc(N)c1)c1S2(=O)=O

InChI

InChI=1S/C12H10N2O2S/c13-7-1-3-9-10-4-2-8(14)6-12(10)17(15,16)11(9)5-7/h1-6H,13-14H2

InChI Key

FUXZRRZSHWQAAA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00159114

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

246.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.878

Distribution Coefficient, logD

0.878

Water Solubility, LogSw

-2.30

Polar Surface Area

70.846

Acid Dissociation Constant (pKa)

21.51

Base Dissociation Constant (pKb)

6.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0108-0030 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Fragments Library (11262 compounds)

Akt-Targeted Library (14764 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Epigenetic
  • Receptor's ligands
Structure:
  • Fragments
Targets:
  • Kinases
  • Phosphatases
  • Phosphatases

References: we are preparing a list of scientific research reports with 0108-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0108-0030?
Check Price and Availability of 0108-0030, 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 0108-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0108-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0108-0030
  • 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 0108-0030 available by request