D692-0559 Screening compound: 2-{[5-(furan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one

D692-0559 Screening compound: 2-{[5-(furan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one
D692-0559 Screening compound: 2-{[5-(furan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D692-0559
2-{[5-(furan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one

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

D692-0559

Molecular Formula

C19H17N5O3S (C19 H17 N5 O3 S)

Compound Name

2-{[5-(furan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one

IUPAC name

2-{[5-(furan-2-yl)-[124]triazolo[43-c]quinazolin-3-yl]sulfanyl}-1-(morpholin-4-yl)ethan-1-one

SMILES

O=C(CSc1nnc2n1c(-c1ccco1)nc1c2cccc1)N1CCOCC1

InChI

InChI=1S/C19H17N5O3S/c25-16(23-7-10-26-11-8-23)12-28-19-22-21-17-13-4-1-2-5-14(13)20-18(24(17)19)15-6-3-9-27-15/h1-6,9H,7-8,10-12H2

InChI Key

UUSIDOXBDXOTIF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27596628

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.914

Distribution Coefficient, logD

1.914

Water Solubility, LogSw

-2.28

Polar Surface Area

63.190

Acid Dissociation Constant (pKa)

19.00

Base Dissociation Constant (pKb)

3.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

D692-0559 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Immunological Library (6760 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with D692-0559 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D692-0559?
Check Price and Availability of D692-0559, 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 D692-0559 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D692-0559
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D692-0559
  • 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 D692-0559 available by request