G072-1775 Screening compound: 7-{[(4-methylphenyl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

G072-1775 Screening compound: 7-{[(4-methylphenyl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
G072-1775 Screening compound: 7-{[(4-methylphenyl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-1775
7-{[(4-methylphenyl)sulfanyl]methyl}-2-propyl-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

G072-1775

Molecular Formula

C16H17N3OS2 (C16 H17 N3 OS2)

Compound Name

7-{[(4-methylphenyl)sulfanyl]methyl}-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

IUPAC name

7-{[(4-methylphenyl)sulfanyl]methyl}-2-propyl-5H-[134]thiadiazolo[32-a]pyrimidin-5-one

SMILES

CCCC(SC1=NC(CSc2ccc(C)cc2)=C2)=NN1C2=O

InChI

InChI=1S/C16H17N3OS2/c1-3-4-14-18-19-15(20)9-12(17-16(19)22-14)10-21-13-7-5-11(2)6-8-13/h5-9H,3-4,10H2,1-2H3

InChI Key

GFSLUSFYXFHXKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14980248

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

331.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.248

Distribution Coefficient, logD

4.246

Water Solubility, LogSw

-4.13

Polar Surface Area

38.174

Acid Dissociation Constant (pKa)

23.95

Base Dissociation Constant (pKb)

5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

G072-1775 in Drug Discovery

Included in Screening Libraries

Purinergic Library (3321 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G072-1775 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-1775?
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What is the minimum amount of G072-1775 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-1775
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-1775
  • 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 G072-1775 available by request