G072-0189 Screening compound: 2-butyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

G072-0189 Screening compound: 2-butyl-7-{[ethyl(3-methylphenyl)amino]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
G072-0189 Screening compound: 2-butyl-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 G072-0189
2-butyl-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

G072-0189

Molecular Formula

C19H24N4OS (C19 H24 N4 OS)

Compound Name

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

IUPAC name

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

SMILES

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

InChI

InChI=1S/C19H24N4OS/c1-4-6-10-17-21-23-18(24)12-15(20-19(23)25-17)13-22(5-2)16-9-7-8-14(3)11-16/h7-9,11-12H,4-6,10,13H2,1-3H3

InChI Key

QFYUROBJOXZHAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14979722

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.520

Distribution Coefficient, logD

4.517

Water Solubility, LogSw

-4.35

Polar Surface Area

41.186

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

5.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

G072-0189 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 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 G072-0189 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G072-0189?
Check Price and Availability of G072-0189, 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 G072-0189 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G072-0189
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G072-0189
  • 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 G072-0189 available by request