C679-2765 Screening compound: 7-[(2,4-dimethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

C679-2765 Screening compound: 7-[(2,4-dimethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
C679-2765 Screening compound: 7-[(2,4-dimethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound C679-2765
7-[(2,4-dimethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-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

C679-2765

Molecular Formula

C15H15N3O2S (C15 H15 N3 O2 S)

Compound Name

7-[(2,4-dimethylphenoxy)methyl]-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

IUPAC name

7-[(24-dimethylphenoxy)methyl]-2-methyl-5H-[134]thiadiazolo[32-a]pyrimidin-5-one

SMILES

CC(SC1=NC(COc2c(C)cc(C)cc2)=C2)=NN1C2=O

InChI

InChI=1S/C15H15N3O2S/c1-9-4-5-13(10(2)6-9)20-8-12-7-14(19)18-15(16-12)21-11(3)17-18/h4-7H,8H2,1-3H3

InChI Key

ZMWFFFKCKDTZGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14781466

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.393

Distribution Coefficient, logD

3.388

Water Solubility, LogSw

-3.59

Polar Surface Area

45.030

Acid Dissociation Constant (pKa)

24.12

Base Dissociation Constant (pKb)

5.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

C679-2765 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Purinergic Library (3321 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
  • Metabolic
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with C679-2765 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C679-2765?
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What is the minimum amount of C679-2765 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C679-2765
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C679-2765
  • 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 C679-2765 available by request