8007-3986 Screening compound: 9,10-dioxo-N-(4-phenylbutyl)-9,10-dihydroanthracene-2-sulfonamide

8007-3986 Screening compound: 9,10-dioxo-N-(4-phenylbutyl)-9,10-dihydroanthracene-2-sulfonamide
8007-3986 Screening compound: 9,10-dioxo-N-(4-phenylbutyl)-9,10-dihydroanthracene-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-3986
9,10-dioxo-N-(4-phenylbutyl)-9,10-dihydroanthracene-2-sulfonamide

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

8007-3986

Molecular Formula

C24H21NO4S (C24 H21 NO4 S)

Compound Name

9,10-dioxo-N-(4-phenylbutyl)-9,10-dihydroanthracene-2-sulfonamide

IUPAC name

910-dioxo-N-(4-phenylbutyl)-910-dihydroanthracene-2-sulfonamide

SMILES

O=C(c1c2cccc1)c(ccc(S(NCCCCc1ccccc1)(=O)=O)c1)c1C2=O

InChI

InChI=1S/C24H21NO4S/c26-23-19-11-4-5-12-20(19)24(27)22-16-18(13-14-21(22)23)30(28,29)25-15-7-6-10-17-8-2-1-3-9-17/h1-5,8-9,11-14,16,25H,6-7,10,15H2

InChI Key

NKLUETGFUZBUNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00758840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.479

Distribution Coefficient, logD

5.479

Water Solubility, LogSw

-5.79

Polar Surface Area

67.780

Acid Dissociation Constant (pKa)

11.07

Base Dissociation Constant (pKb)

-5.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8007-3986 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 8007-3986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-3986?
Check Price and Availability of 8007-3986, 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 8007-3986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-3986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-3986
  • 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 8007-3986 available by request