F092-0103 Screening compound: 3-(3-methoxyphenyl)-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

F092-0103 Screening compound: 3-(3-methoxyphenyl)-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
F092-0103 Screening compound: 3-(3-methoxyphenyl)-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]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 F092-0103
3-(3-methoxyphenyl)-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]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

F092-0103

Molecular Formula

C20H22N4O3S3 (C20 H22 N4 O3 S3)

Compound Name

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

IUPAC name

3-(3-methoxyphenyl)-5-{[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-2-sulfanylidene-2H3H6H7H-[13]thiazolo[45-d]pyrimidin-7-one

SMILES

CC(CCCC1)N1C(CSC(NC1=O)=NC(N2c3cc(OC)ccc3)=C1SC2=S)=O

InChI

InChI=1S/C20H22N4O3S3/c1-12-6-3-4-9-23(12)15(25)11-29-19-21-17-16(18(26)22-19)30-20(28)24(17)13-7-5-8-14(10-13)27-2/h5,7-8,10,12H,3-4,6,9,11H2,1-2H3,(H,21,22,26)/t12-/m0/s1

InChI Key

QCDIAVLYCQMFKM-LBPRGKRZSA-N

MDL Number (MFCD)

MFCD14941016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

462.62

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.039

Distribution Coefficient, logD

3.037

Water Solubility, LogSw

-3.41

Polar Surface Area

59.517

Acid Dissociation Constant (pKa)

9.83

Base Dissociation Constant (pKb)

1.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with F092-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F092-0103?
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What is the minimum amount of F092-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F092-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F092-0103
  • 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 F092-0103 available by request