G565-0398 Screening compound: 2-ethyl-7-({[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

G565-0398 Screening compound: 2-ethyl-7-({[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
G565-0398 Screening compound: 2-ethyl-7-({[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G565-0398
2-ethyl-7-({[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}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

G565-0398

Molecular Formula

C15H14N6O2S2 (C15 H14 N6 O2 S2)

Compound Name

2-ethyl-7-({[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

IUPAC name

2-ethyl-7-({[5-(furan-2-yl)-4-methyl-4H-124-triazol-3-yl]sulfanyl}methyl)-5H-[134]thiadiazolo[32-a]pyrimidin-5-one

SMILES

CCC(SC1=NC(CSc2nnc(-c3ccco3)n2C)=C2)=NN1C2=O

InChI

InChI=1S/C15H14N6O2S2/c1-3-11-19-21-12(22)7-9(16-14(21)25-11)8-24-15-18-17-13(20(15)2)10-5-4-6-23-10/h4-7H,3,8H2,1-2H3

InChI Key

IKWJMPQQKBUVDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07680786

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.945

Distribution Coefficient, logD

1.942

Water Solubility, LogSw

-2.30

Polar Surface Area

71.837

Acid Dissociation Constant (pKa)

22.73

Base Dissociation Constant (pKb)

5.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

G565-0398 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G565-0398 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G565-0398?
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What is the minimum amount of G565-0398 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G565-0398
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G565-0398
  • 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 G565-0398 available by request