D718-0275 Screening compound: ethyl 2-[2-(methylsulfanyl)-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate

D718-0275 Screening compound: ethyl 2-[2-(methylsulfanyl)-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate
D718-0275 Screening compound: ethyl 2-[2-(methylsulfanyl)-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound D718-0275
ethyl 2-[2-(methylsulfanyl)-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate

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

D718-0275

Molecular Formula

C10H12N4O3S (C10 H12 N4 O3 S)

Compound Name

ethyl 2-[2-(methylsulfanyl)-7-oxo-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]acetate

IUPAC name

ethyl 2-[2-(methylsulfanyl)-7-oxo-4H7H-[124]triazolo[15-a]pyrimidin-5-yl]acetate

SMILES

CCOC(CC(Nc1nc(SC)nn11)=CC1=O)=O

InChI

InChI=1S/C10H12N4O3S/c1-3-17-8(16)5-6-4-7(15)14-9(11-6)12-10(13-14)18-2/h4H,3,5H2,1-2H3,(H,11,12,13)

InChI Key

JQQBDENYGWTCQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08591759

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

268.3

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.900

Distribution Coefficient, logD

-0.286

Water Solubility, LogSw

-2.14

Polar Surface Area

70.493

Acid Dissociation Constant (pKa)

6.24

Base Dissociation Constant (pKb)

-4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

D718-0275 in Drug Discovery

Included in Screening Libraries

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D718-0275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D718-0275?
Check Price and Availability of D718-0275, 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 D718-0275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D718-0275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D718-0275
  • 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 D718-0275 available by request