F294-0629 Screening compound: 2-[benzyl(butyl)amino]-5-(4-methoxybenzenesulfonamido)benzoic acid

F294-0629 Screening compound: 2-[benzyl(butyl)amino]-5-(4-methoxybenzenesulfonamido)benzoic acid
F294-0629 Screening compound: 2-[benzyl(butyl)amino]-5-(4-methoxybenzenesulfonamido)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound F294-0629
2-[benzyl(butyl)amino]-5-(4-methoxybenzenesulfonamido)benzoic 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

F294-0629

Molecular Formula

C25H28N2O5S (C25 H28 N2 O5 S)

Compound Name

2-[benzyl(butyl)amino]-5-(4-methoxybenzenesulfonamido)benzoic acid

IUPAC name

2-[benzyl(butyl)amino]-5-(4-methoxybenzenesulfonamido)benzoic acid

SMILES

CCCCN(Cc1ccccc1)c(ccc(NS(c(cc1)ccc1OC)(=O)=O)c1)c1C(O)=O

InChI

InChI=1S/C25H28N2O5S/c1-3-4-16-27(18-19-8-6-5-7-9-19)24-15-10-20(17-23(24)25(28)29)26-33(30,31)22-13-11-21(32-2)12-14-22/h5-15,17,26H,3-4,16,18H2,1-2H3,(H,28,29)

InChI Key

HMAQDYYPNJRIKQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27113363

Chemical and Physical Properties

Saltdata

CF3COOH

Molecular Weight

468.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.534

Distribution Coefficient, logD

3.702

Water Solubility, LogSw

-5.25

Polar Surface Area

79.533

Acid Dissociation Constant (pKa)

5.57

Base Dissociation Constant (pKb)

2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

F294-0629 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F294-0629 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F294-0629?
Check Price and Availability of F294-0629, 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 F294-0629 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F294-0629
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F294-0629
  • 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 F294-0629 available by request