G072-1315 Screening compound: 2-(2-chlorophenoxy)-N-{2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}acetamide

G072-1315 Screening compound: 2-(2-chlorophenoxy)-N-{2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}acetamide
G072-1315 Screening compound: 2-(2-chlorophenoxy)-N-{2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-1315
2-(2-chlorophenoxy)-N-{2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}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

G072-1315

Molecular Formula

C21H16ClN3O3S2 (C21 H16 ClN3 O3 S2)

Compound Name

2-(2-chlorophenoxy)-N-{2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}acetamide

IUPAC name

2-(2-chlorophenoxy)-N-{2-[({5-oxo-5H-[13]thiazolo[32-a]pyrimidin-7-yl}methyl)sulfanyl]phenyl}acetamide

SMILES

O=C(COc(cccc1)c1Cl)Nc(cccc1)c1SCC(N=C1SC=CN11)=CC1=O

InChI

InChI=1S/C21H16ClN3O3S2/c22-15-5-1-3-7-17(15)28-12-19(26)24-16-6-2-4-8-18(16)30-13-14-11-20(27)25-9-10-29-21(25)23-14/h1-11H,12-13H2,(H,24,26)

InChI Key

MBGLUDUQTGKVDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14980050

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.96

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.047

Distribution Coefficient, logD

3.047

Water Solubility, LogSw

-3.46

Polar Surface Area

55.688

Acid Dissociation Constant (pKa)

12.38

Base Dissociation Constant (pKb)

2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.50

G072-1315 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 G072-1315 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-1315?
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What is the minimum amount of G072-1315 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-1315
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-1315
  • 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 G072-1315 available by request