8009-7168 Screening compound: 2-(4-acetamidobenzenesulfonamido)butanoic acid

8009-7168 Screening compound: 2-(4-acetamidobenzenesulfonamido)butanoic acid
8009-7168 Screening compound: 2-(4-acetamidobenzenesulfonamido)butanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-7168
2-(4-acetamidobenzenesulfonamido)butanoic 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

8009-7168

Molecular Formula

C12H16N2O5S (C12 H16 N2 O5 S)

Compound Name

2-(4-acetamidobenzenesulfonamido)butanoic acid

IUPAC name

2-(4-acetamidobenzenesulfonamido)butanoic acid

SMILES

CCC(C(O)=O)NS(c(cc1)ccc1NC(C)=O)(=O)=O

InChI

InChI=1S/C12H16N2O5S/c1-3-11(12(16)17)14-20(18,19)10-6-4-9(5-7-10)13-8(2)15/h4-7,11,14H,3H2,1-2H3,(H,13,15)(H,16,17)/t11-/m0/s1

InChI Key

DERCDELOZKOELA-NSHDSACASA-N

MDL Number (MFCD)

MFCD01819857

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.34

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.092

Distribution Coefficient, logD

-3.671

Water Solubility, LogSw

-2.03

Polar Surface Area

93.782

Acid Dissociation Constant (pKa)

3.64

Base Dissociation Constant (pKb)

-1.73

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.30

8009-7168 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Integrin Receptors Targeted library (1715 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 8009-7168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-7168?
Check Price and Availability of 8009-7168, 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 8009-7168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-7168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-7168
  • 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 8009-7168 available by request