6404-0191 Screening compound: 5-amino-3-(propylsulfanyl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol

6404-0191 Screening compound: 5-amino-3-(propylsulfanyl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol
6404-0191 Screening compound: 5-amino-3-(propylsulfanyl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6404-0191
5-amino-3-(propylsulfanyl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol

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

6404-0191

Molecular Formula

C8H11N5OS (C8 H11 N5 OS)

Compound Name

5-amino-3-(propylsulfanyl)-[1,2,4]triazolo[4,3-a]pyrimidin-7-ol

IUPAC name

5-amino-3-(propylsulfanyl)-[124]triazolo[43-a]pyrimidin-7-ol

SMILES

CCCSc(n1c(N)c2)nnc1nc2O

InChI

InChI=1S/C8H11N5OS/c1-2-3-15-8-12-11-7-10-6(14)4-5(9)13(7)8/h4H,2-3,9H2,1H3,(H,10,11,14)

InChI Key

SYNCKNPNXYZSMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04214305

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

225.27

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.627

Distribution Coefficient, logD

0.411

Water Solubility, LogSw

-1.30

Polar Surface Area

69.338

Acid Dissociation Constant (pKa)

7.59

Base Dissociation Constant (pKb)

2.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

6404-0191 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6404-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6404-0191?
Check Price and Availability of 6404-0191, 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 6404-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6404-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6404-0191
  • 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 6404-0191 available by request