8017-9276 Screening compound: 2-[(2-fluorobenzyl)sulfanyl]-7-hydroxy[1,3]thiazolo[4,5-b]pyridin-5(4H)-one

8017-9276 Screening compound: 2-[(2-fluorobenzyl)sulfanyl]-7-hydroxy[1,3]thiazolo[4,5-b]pyridin-5(4H)-one
8017-9276 Screening compound: 2-[(2-fluorobenzyl)sulfanyl]-7-hydroxy[1,3]thiazolo[4,5-b]pyridin-5(4H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9276
2-[(2-fluorobenzyl)sulfanyl]-7-hydroxy[1,3]thiazolo[4,5-b]pyridin-5(4H)-one

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

8017-9276

Molecular Formula

C13H9FN2O2S2 (C13 H9 FN2 O2 S2)

Compound Name

2-[(2-fluorobenzyl)sulfanyl]-7-hydroxy[1,3]thiazolo[4,5-b]pyridin-5(4H)-one

IUPAC name

2-{[(2-fluorophenyl)methyl]sulfanyl}-7-hydroxy-4H5H-[13]thiazolo[45-b]pyridin-5-one

SMILES

OC(c1c(N2)nc(SCc(cccc3)c3F)s1)=CC2=O

InChI

InChI=1S/C13H9FN2O2S2/c14-8-4-2-1-3-7(8)6-19-13-16-12-11(20-13)9(17)5-10(18)15-12/h1-5H,6H2,(H2,15,17,18)

InChI Key

CWXRUWKMGCNONY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06619294

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.106

Distribution Coefficient, logD

-2.213

Water Solubility, LogSw

-3.33

Polar Surface Area

50.575

Acid Dissociation Constant (pKa)

2.08

Base Dissociation Constant (pKb)

-4.30

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.69

References: we are preparing a list of scientific research reports with 8017-9276 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9276?
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What is the minimum amount of 8017-9276 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9276
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9276
  • 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 8017-9276 available by request