F143-0289 Screening compound: 3-({[3-(4-chlorophenyl)-6-methyl-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)-4-methoxybenzaldehyde

F143-0289 Screening compound: 3-({[3-(4-chlorophenyl)-6-methyl-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)-4-methoxybenzaldehyde
F143-0289 Screening compound: 3-({[3-(4-chlorophenyl)-6-methyl-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)-4-methoxybenzaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound F143-0289
3-({[3-(4-chlorophenyl)-6-methyl-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)-4-methoxybenzaldehyde

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

F143-0289

Molecular Formula

C21H16ClN3O3S3 (C21 H16 ClN3 O3 S3)

Compound Name

3-({[3-(4-chlorophenyl)-6-methyl-7-oxo-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}methyl)-4-methoxybenzaldehyde

IUPAC name

3-({[3-(4-chlorophenyl)-6-methyl-7-oxo-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-5-yl]sulfanyl}methyl)-4-methoxybenzaldehyde

SMILES

CN(C1=O)C(SCc(cc(C=O)cc2)c2OC)=NC(N2c(cc3)ccc3Cl)=C1SC2=S

InChI

InChI=1S/C21H16ClN3O3S3/c1-24-19(27)17-18(25(21(29)31-17)15-6-4-14(22)5-7-15)23-20(24)30-11-13-9-12(10-26)3-8-16(13)28-2/h3-10H,11H2,1-2H3

InChI Key

HSIKFGNSDPUPME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14943040

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

490.03

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.335

Distribution Coefficient, logD

4.335

Water Solubility, LogSw

-4.86

Polar Surface Area

49.393

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-3.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

F143-0289 in Drug Discovery

Included in Screening Libraries

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

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with F143-0289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F143-0289?
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What is the minimum amount of F143-0289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F143-0289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F143-0289
  • 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 F143-0289 available by request