R205-0030 Screening compound: 5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol

R205-0030 Screening compound: 5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol
R205-0030 Screening compound: 5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol alternative view

Chemical Structure Depiction of ChemDiv screening compound R205-0030
5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol

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

R205-0030

Molecular Formula

C7H8N4S (C7 H8 N4 S)

Compound Name

5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine-3-thiol

IUPAC name

57-dimethyl-[124]triazolo[43-a]pyrimidine-3-thiol

SMILES

Cc(n12)cc(C)nc2nnc1S

InChI

InChI=1S/C7H8N4S/c1-4-3-5(2)11-6(8-4)9-10-7(11)12/h3H,1-2H3,(H,10,12)

InChI Key

YINCJELKAOSUAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01945125

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

180.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.399

Distribution Coefficient, logD

0.314

Water Solubility, LogSw

-0.81

Polar Surface Area

30.398

Acid Dissociation Constant (pKa)

8.07

Base Dissociation Constant (pKb)

1.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

R205-0030 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Fragments Library (11262 compounds)

Human Kinases Annotated Library (2415 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases
  • Proteases
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with R205-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R205-0030?
Check Price and Availability of R205-0030, 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 R205-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R205-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R205-0030
  • 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 R205-0030 available by request