M109-0706 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-{[6-ethyl-3-(4-methylphenyl)-7-oxo-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide

M109-0706 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-{[6-ethyl-3-(4-methylphenyl)-7-oxo-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
M109-0706 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-{[6-ethyl-3-(4-methylphenyl)-7-oxo-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M109-0706
N-[2-(4-chlorophenyl)ethyl]-2-{[6-ethyl-3-(4-methylphenyl)-7-oxo-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide

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

M109-0706

Molecular Formula

C24H23ClN4O2S2 (C24 H23 ClN4 O2 S2)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-2-{[6-ethyl-3-(4-methylphenyl)-7-oxo-6H,7H-[1,2]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-2-{[6-ethyl-3-(4-methylphenyl)-7-oxo-6H7H-[12]thiazolo[45-d]pyrimidin-5-yl]sulfanyl}acetamide

SMILES

CCN(C1=O)C(SCC(NCCc(cc2)ccc2Cl)=O)=Nc2c1snc2-c1ccc(C)cc1

InChI

InChI=1S/C24H23ClN4O2S2/c1-3-29-23(31)22-21(20(28-33-22)17-8-4-15(2)5-9-17)27-24(29)32-14-19(30)26-13-12-16-6-10-18(25)11-7-16/h4-11H,3,12-14H2,1-2H3,(H,26,30)

InChI Key

MOLAFSLPHXSAMO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15140989

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

499.06

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.606

Distribution Coefficient, logD

4.606

Water Solubility, LogSw

-4.75

Polar Surface Area

58.819

Acid Dissociation Constant (pKa)

14.88

Base Dissociation Constant (pKb)

0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

M109-0706 in Drug Discovery

Included in Screening Libraries

Cysteine Proteases Inhibitors Library (7839 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Cardiovascular
  • Skin
  • Metabolic
  • Endocrine
  • Immune system
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with M109-0706 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M109-0706?
Check Price and Availability of M109-0706, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M109-0706 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M109-0706
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M109-0706
  • 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 M109-0706 available by request