G072-0103 Screening compound: 2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

G072-0103 Screening compound: 2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
G072-0103 Screening compound: 2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G072-0103
2-ethyl-7-{[ethyl(3-methylphenyl)amino]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

G072-0103

Molecular Formula

C17H20N4OS (C17 H20 N4 OS)

Compound Name

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

IUPAC name

2-ethyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[134]thiadiazolo[32-a]pyrimidin-5-one

SMILES

CCC(SC1=NC(CN(CC)c2cc(C)ccc2)=C2)=NN1C2=O

InChI

InChI=1S/C17H20N4OS/c1-4-15-19-21-16(22)10-13(18-17(21)23-15)11-20(5-2)14-8-6-7-12(3)9-14/h6-10H,4-5,11H2,1-3H3

InChI Key

PEYGMQZAKGZOEP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14979682

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.543

Distribution Coefficient, logD

3.525

Water Solubility, LogSw

-3.60

Polar Surface Area

41.186

Acid Dissociation Constant (pKa)

23.59

Base Dissociation Constant (pKb)

6.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.30

G072-0103 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Targeted Diversity Library (40567 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with G072-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-0103?
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What is the minimum amount of G072-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-0103
  • 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 G072-0103 available by request