F820-0688 Screening compound: 3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-2-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

F820-0688 Screening compound: 3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-2-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
F820-0688 Screening compound: 3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-2-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F820-0688
3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-2-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-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

F820-0688

Molecular Formula

C18H18N4O5S2 (C18 H18 N4 O5 S2)

Compound Name

3-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-2-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3-dihydro-1,3-benzoxazole-6-sulfonamide

IUPAC name

3-[(5-ethyl-124-oxadiazol-3-yl)methyl]-2-oxo-N-[2-(thiophen-2-yl)ethyl]-23-dihydro-13-benzoxazole-6-sulfonamide

SMILES

CCc1nc(CN(c(ccc(S(NCCc2cccs2)(=O)=O)c2)c2O2)C2=O)no1

InChI

InChI=1S/C18H18N4O5S2/c1-2-17-20-16(21-27-17)11-22-14-6-5-13(10-15(14)26-18(22)23)29(24,25)19-8-7-12-4-3-9-28-12/h3-6,9-10,19H,2,7-8,11H2,1H3

InChI Key

PVVOJUKRWUWHHT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27195690

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.5

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.933

Distribution Coefficient, logD

2.933

Water Solubility, LogSw

-3.68

Polar Surface Area

98.290

Acid Dissociation Constant (pKa)

11.06

Base Dissociation Constant (pKb)

-4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

F820-0688 in Drug Discovery

Included in Screening Libraries

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with F820-0688 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F820-0688?
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What is the minimum amount of F820-0688 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F820-0688
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F820-0688
  • 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 F820-0688 available by request