8010-8899 Screening compound: 5-phenyl-7-(thiophen-2-yl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

8010-8899 Screening compound: 5-phenyl-7-(thiophen-2-yl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine
8010-8899 Screening compound: 5-phenyl-7-(thiophen-2-yl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-8899
5-phenyl-7-(thiophen-2-yl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-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

8010-8899

Molecular Formula

C15H14N4S (C15 H14 N4 S)

Compound Name

5-phenyl-7-(thiophen-2-yl)-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

IUPAC name

(5S7R)-5-phenyl-7-(thiophen-2-yl)-4H5H6H7H-[124]triazolo[15-a]pyrimidine

SMILES

C1[C@@H](c2ccccc2)Nc2ncnn2[C@H]1c1cccs1

InChI

InChI=1S/C15H14N4S/c1-2-5-11(6-3-1)12-9-13(14-7-4-8-20-14)19-15(18-12)16-10-17-19/h1-8,10,12-13H,9H2,(H,16,17,18)/t12-,13-/m1/s1

InChI Key

VSLROSACIMFOLI-CHWSQXEVSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.37

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.057

Distribution Coefficient, logD

3.057

Water Solubility, LogSw

-3.14

Polar Surface Area

40.087

Acid Dissociation Constant (pKa)

15.81

Base Dissociation Constant (pKb)

4.26

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

20.00

8010-8899 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Antiparasite Library (23996 compounds)

Antiviral HBV Library (10007 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8010-8899 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-8899?
Check Price and Availability of 8010-8899, 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 8010-8899 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-8899
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-8899
  • 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 8010-8899 available by request