C276-1701 Screening compound: 7-[4-(methylsulfanyl)phenyl]-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid

C276-1701 Screening compound: 7-[4-(methylsulfanyl)phenyl]-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
C276-1701 Screening compound: 7-[4-(methylsulfanyl)phenyl]-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C276-1701
7-[4-(methylsulfanyl)phenyl]-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid

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

C276-1701

Molecular Formula

C13H12N4O2S (C13 H12 N4 O2 S)

Compound Name

7-[4-(methylsulfanyl)phenyl]-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid

IUPAC name

7-[4-(methylsulfanyl)phenyl]-4H7H-[124]triazolo[15-a]pyrimidine-5-carboxylic acid

SMILES

CSc1ccc(C2n3ncnc3NC(C(O)=O)=C2)cc1

InChI

InChI=1S/C13H12N4O2S/c1-20-9-4-2-8(3-5-9)11-6-10(12(18)19)16-13-14-7-15-17(11)13/h2-7,11H,1H3,(H,18,19)(H,14,15,16)/t11-/m0/s1

InChI Key

IOEUMGDZRCIYSM-NSHDSACASA-N

MDL Number (MFCD)

MFCD09785483

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.973

Distribution Coefficient, logD

-1.666

Water Solubility, LogSw

-2.65

Polar Surface Area

67.280

Acid Dissociation Constant (pKa)

3.76

Base Dissociation Constant (pKb)

-0.98

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

15.40

C276-1701 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

BRD4 Targeted Library (4534 compounds)

RNA-Protein Interaction Inhibitors Library (1986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
Targets:
  • Others

References: we are preparing a list of scientific research reports with C276-1701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C276-1701?
Check Price and Availability of C276-1701, 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 C276-1701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C276-1701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C276-1701
  • 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 C276-1701 available by request