F895-2468 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonamido]acetamide

F895-2468 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonamido]acetamide
F895-2468 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F895-2468
N-[(3,4-dimethoxyphenyl)methyl]-2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonamido]acetamide

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

F895-2468

Molecular Formula

C20H24N4O6S2 (C20 H24 N4 O6 S2)

Compound Name

N-[(3,4-dimethoxyphenyl)methyl]-2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonamido]acetamide

IUPAC name

N-[(34-dimethoxyphenyl)methyl]-2-[5-(5-ethyl-124-oxadiazol-3-yl)-2-methylthiophene-3-sulfonamido]acetamide

SMILES

CCc1nc(-c2cc(S(NCC(NCc(cc3)cc(OC)c3OC)=O)(=O)=O)c(C)s2)no1

InChI

InChI=1S/C20H24N4O6S2/c1-5-19-23-20(24-30-19)16-9-17(12(2)31-16)32(26,27)22-11-18(25)21-10-13-6-7-14(28-3)15(8-13)29-4/h6-9,22H,5,10-11H2,1-4H3,(H,21,25)

InChI Key

HQPLCDMKOLFCOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27202727

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.57

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.862

Distribution Coefficient, logD

2.856

Water Solubility, LogSw

-3.41

Polar Surface Area

114.090

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

F895-2468 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Antibacterial Compounds Library (13827 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F895-2468 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F895-2468?
Check Price and Availability of F895-2468, 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 F895-2468 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F895-2468
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F895-2468
  • 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 F895-2468 available by request