D718-1064 Screening compound: 3-[5-(prop-2-yn-1-ylsulfanyl)-[1,2,4]triazolo[1,5-c]quinazolin-2-yl]pyridine

D718-1064 Screening compound: 3-[5-(prop-2-yn-1-ylsulfanyl)-[1,2,4]triazolo[1,5-c]quinazolin-2-yl]pyridine
D718-1064 Screening compound: 3-[5-(prop-2-yn-1-ylsulfanyl)-[1,2,4]triazolo[1,5-c]quinazolin-2-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound D718-1064
3-[5-(prop-2-yn-1-ylsulfanyl)-[1,2,4]triazolo[1,5-c]quinazolin-2-yl]pyridine

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

D718-1064

Molecular Formula

C17H11N5S (C17 H11 N5 S)

Compound Name

3-[5-(prop-2-yn-1-ylsulfanyl)-[1,2,4]triazolo[1,5-c]quinazolin-2-yl]pyridine

IUPAC name

3-[5-(prop-2-yn-1-ylsulfanyl)-[124]triazolo[15-c]quinazolin-2-yl]pyridine

SMILES

C#CCSc1nc(cccc2)c2c2nc(-c3cnccc3)nn12

InChI

InChI=1S/C17H11N5S/c1-2-10-23-17-19-14-8-4-3-7-13(14)16-20-15(21-22(16)17)12-6-5-9-18-11-12/h1,3-9,11H,10H2

InChI Key

NMZCKAXEXHHLDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08592729

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.010

Distribution Coefficient, logD

2.537

Water Solubility, LogSw

-2.72

Polar Surface Area

39.586

Acid Dissociation Constant (pKa)

23.04

Base Dissociation Constant (pKb)

7.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

D718-1064 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Akt-Targeted Library (14764 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Structure:
  • Cyclic compounds
  • 3D
  • Fragments
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D718-1064 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D718-1064?
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What is the minimum amount of D718-1064 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D718-1064
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D718-1064
  • 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 D718-1064 available by request