G200-0071 Screening compound: 2-ethyl-7-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfonyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

G200-0071 Screening compound: 2-ethyl-7-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfonyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
G200-0071 Screening compound: 2-ethyl-7-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfonyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G200-0071
2-ethyl-7-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfonyl]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

G200-0071

Molecular Formula

C16H14N6O3S2 (C16 H14 N6 O3 S2)

Compound Name

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

IUPAC name

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

SMILES

CCC(SC1=NC(CS(c2nnc(-c3ccccc3)[nH]2)(=O)=O)=C2)=NN1C2=O

InChI

InChI=1S/C16H14N6O3S2/c1-2-12-21-22-13(23)8-11(17-16(22)26-12)9-27(24,25)15-18-14(19-20-15)10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,18,19,20)

InChI Key

HJUIUVIQZQZYLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14985189

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.46

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.350

Distribution Coefficient, logD

-2.232

Water Solubility, LogSw

-2.32

Polar Surface Area

100.545

Acid Dissociation Constant (pKa)

3.12

Base Dissociation Constant (pKb)

5.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

G200-0071 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with G200-0071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G200-0071?
Check Price and Availability of G200-0071, 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 G200-0071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G200-0071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G200-0071
  • 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 G200-0071 available by request