6770-0034 Screening compound: 3-(decylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine

6770-0034 Screening compound: 3-(decylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine
6770-0034 Screening compound: 3-(decylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 6770-0034
3-(decylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine

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

6770-0034

Molecular Formula

C17H28N4S (C17 H28 N4 S)

Compound Name

3-(decylsulfanyl)-5,7-dimethyl-[1,2,4]triazolo[4,3-a]pyrimidine

IUPAC name

3-(decylsulfanyl)-57-dimethyl-[124]triazolo[43-a]pyrimidine

SMILES

CCCCCCCCCCSc1nnc2nc(C)cc(C)n12

InChI

InChI=1S/C17H28N4S/c1-4-5-6-7-8-9-10-11-12-22-17-20-19-16-18-14(2)13-15(3)21(16)17/h13H,4-12H2,1-3H3

InChI Key

TUIUKFKZNPKJCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05826355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.5

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.566

Distribution Coefficient, logD

5.566

Water Solubility, LogSw

-5.40

Polar Surface Area

31.925

Acid Dissociation Constant (pKa)

24.64

Base Dissociation Constant (pKb)

3.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

70.60

References: we are preparing a list of scientific research reports with 6770-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6770-0034?
Check Price and Availability of 6770-0034, 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 6770-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6770-0034
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6770-0034
  • 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 6770-0034 available by request