F398-0047 Screening compound: 5-[(5-bromothiophen-2-yl)sulfonyl]-2-(4-methoxyphenyl)-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine

F398-0047 Screening compound: 5-[(5-bromothiophen-2-yl)sulfonyl]-2-(4-methoxyphenyl)-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine
F398-0047 Screening compound: 5-[(5-bromothiophen-2-yl)sulfonyl]-2-(4-methoxyphenyl)-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound F398-0047
5-[(5-bromothiophen-2-yl)sulfonyl]-2-(4-methoxyphenyl)-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine

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

F398-0047

Molecular Formula

C17H15BrN2O3S3 (C17 H15 BrN2 O3 S3)

Compound Name

5-[(5-bromothiophen-2-yl)sulfonyl]-2-(4-methoxyphenyl)-4H,5H,6H,7H-[1,3]thiazolo[5,4-c]pyridine

IUPAC name

5-[(5-bromothiophen-2-yl)sulfonyl]-2-(4-methoxyphenyl)-4H5H6H7H-[13]thiazolo[54-c]pyridine

SMILES

COc(cc1)ccc1-c1nc(CCN(C2)S(c(s3)ccc3Br)(=O)=O)c2s1

InChI

InChI=1S/C17H15BrN2O3S3/c1-23-12-4-2-11(3-5-12)17-19-13-8-9-20(10-14(13)24-17)26(21,22)16-7-6-15(18)25-16/h2-7H,8-10H2,1H3

InChI Key

PTFPLKORQNJDQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27123283

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.939

Distribution Coefficient, logD

4.939

Water Solubility, LogSw

-4.59

Polar Surface Area

51.408

Acid Dissociation Constant (pKa)

26.68

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

F398-0047 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F398-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F398-0047?
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What is the minimum amount of F398-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F398-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F398-0047
  • 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 F398-0047 available by request