0482-0035 Screening compound: 1-amino-9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracene-2-sulfonic acid

0482-0035 Screening compound: 1-amino-9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracene-2-sulfonic acid
0482-0035 Screening compound: 1-amino-9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracene-2-sulfonic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0482-0035
1-amino-9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracene-2-sulfonic acid

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

0482-0035

Molecular Formula

C20H14N2O5S (C20 H14 N2 O5 S)

Compound Name

1-amino-9,10-dioxo-4-(phenylamino)-9,10-dihydroanthracene-2-sulfonic acid

IUPAC name

1-amino-910-dioxo-4-(phenylamino)-910-dihydroanthracene-2-sulfonic acid

SMILES

Nc(c(C(c1c2cccc1)=O)c(c(Nc1ccccc1)c1)C2=O)c1S(O)(=O)=O

InChI

InChI=1S/C20H14N2O5S/c21-18-15(28(25,26)27)10-14(22-11-6-2-1-3-7-11)16-17(18)20(24)13-9-5-4-8-12(13)19(16)23/h1-10,22H,21H2,(H,25,26,27)

InChI Key

OPBOOIFXQHPAPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00357237

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.834

Distribution Coefficient, logD

-11.866

Water Solubility, LogSw

-2.83

Polar Surface Area

96.195

Acid Dissociation Constant (pKa)

-3.39

Base Dissociation Constant (pKb)

-4.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0482-0035 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Carbonic Anhydrase II Library (4939 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Others
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0482-0035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0482-0035?
Check Price and Availability of 0482-0035, 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 0482-0035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0482-0035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0482-0035
  • 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 0482-0035 available by request