F895-0075 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)thiophene-3-sulfonamido]acetamide

F895-0075 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)thiophene-3-sulfonamido]acetamide
F895-0075 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)thiophene-3-sulfonamido]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F895-0075
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)thiophene-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

F895-0075

Molecular Formula

C18H18N4O6S2 (C18 H18 N4 O6 S2)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)thiophene-3-sulfonamido]acetamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-2-[2-methyl-5-(5-methyl-124-oxadiazol-3-yl)thiophene-3-sulfonamido]acetamide

SMILES

Cc(sc(-c1noc(C)n1)c1)c1S(NCC(NCc(cc1)cc2c1OCO2)=O)(=O)=O

InChI

InChI=1S/C18H18N4O6S2/c1-10-16(6-15(29-10)18-21-11(2)28-22-18)30(24,25)20-8-17(23)19-7-12-3-4-13-14(5-12)27-9-26-13/h3-6,20H,7-9H2,1-2H3,(H,19,23)

InChI Key

SSWCTASCQHEVHC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27202673

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

450.5

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.509

Distribution Coefficient, logD

2.503

Water Solubility, LogSw

-3.01

Polar Surface Area

115.507

Acid Dissociation Constant (pKa)

9.25

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

F895-0075 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 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
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F895-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F895-0075?
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What is the minimum amount of F895-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F895-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F895-0075
  • 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 F895-0075 available by request