F092-0702 Screening compound: 3-(5-chloro-2-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

F092-0702 Screening compound: 3-(5-chloro-2-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
F092-0702 Screening compound: 3-(5-chloro-2-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F092-0702
3-(5-chloro-2-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-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

F092-0702

Molecular Formula

C20H16ClN3O3S3 (C20 H16 ClN3 O3 S3)

Compound Name

3-(5-chloro-2-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

IUPAC name

3-(5-chloro-2-methoxyphenyl)-5-{[(3-methoxyphenyl)methyl]sulfanyl}-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-7-one

SMILES

COc1cccc(CSC(NC2=O)=NC(N3c(cc(cc4)Cl)c4OC)=C2SC3=S)c1

InChI

InChI=1S/C20H16ClN3O3S3/c1-26-13-5-3-4-11(8-13)10-29-19-22-17-16(18(25)23-19)30-20(28)24(17)14-9-12(21)6-7-15(14)27-2/h3-9H,10H2,1-2H3,(H,22,23,25)

InChI Key

DPUDRGZHXANQDZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14941205

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.02

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.405

Distribution Coefficient, logD

4.404

Water Solubility, LogSw

-4.67

Polar Surface Area

51.169

Acid Dissociation Constant (pKa)

10.05

Base Dissociation Constant (pKb)

1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

References: we are preparing a list of scientific research reports with F092-0702 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F092-0702?
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What is the minimum amount of F092-0702 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F092-0702
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F092-0702
  • 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 F092-0702 available by request