1147-0101 Screening compound: 4-hydroxy-3-[(1E)-2-(4-sulfonatonaphthalen-1-yl)diazen-1-yl]naphthalene-1-sulfonate

1147-0101 Screening compound: 4-hydroxy-3-[(1E)-2-(4-sulfonatonaphthalen-1-yl)diazen-1-yl]naphthalene-1-sulfonate
1147-0101 Screening compound: 4-hydroxy-3-[(1E)-2-(4-sulfonatonaphthalen-1-yl)diazen-1-yl]naphthalene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1147-0101
4-hydroxy-3-[(1E)-2-(4-sulfonatonaphthalen-1-yl)diazen-1-yl]naphthalene-1-sulfonate

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

1147-0101

Molecular Formula

C20H12N2O7S2 (C20 H12 N2 O7 S2)

Compound Name

4-hydroxy-3-[(1E)-2-(4-sulfonatonaphthalen-1-yl)diazen-1-yl]naphthalene-1-sulfonate

IUPAC name

4-hydroxy-3-[(1E)-2-(4-sulfonatonaphthalen-1-yl)diazen-1-yl]naphthalene-1-sulfonate

SMILES

[O-]S(c(c1ccccc11)ccc1/N=N/c(cc(c1ccccc11)S([O-])(=O)=O)c1O)(=O)=O

InChI

InChI=1S/C20H14N2O7S2/c23-20-15-8-4-3-7-14(15)19(31(27,28)29)11-17(20)22-21-16-9-10-18(30(24,25)26)13-6-2-1-5-12(13)16/h1-11,23H,(H,24,25,26)(H,27,28,29)/p-2/b22-21+

InChI Key

TVWOWDDBXAFQDG-QURGRASLSA-L

MDL Number (MFCD)

MFCD01536521

Chemical and Physical Properties

Saltdata

2Na+

Molecular Weight

456.46

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

-0.048

Distribution Coefficient, logD

-1.376

Water Solubility, LogSw

-2.06

Polar Surface Area

120.294

Acid Dissociation Constant (pKa)

6.09

Base Dissociation Constant (pKb)

-3.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1147-0101 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 1147-0101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1147-0101?
Check Price and Availability of 1147-0101, 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 1147-0101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1147-0101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1147-0101
  • 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 1147-0101 available by request