L541-0833 Screening compound: 6-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-7-[(pyridin-4-yl)methyl]-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-8-one

L541-0833 Screening compound: 6-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-7-[(pyridin-4-yl)methyl]-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-8-one
L541-0833 Screening compound: 6-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-7-[(pyridin-4-yl)methyl]-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-8-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L541-0833
6-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-7-[(pyridin-4-yl)methyl]-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-8-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

L541-0833

Molecular Formula

C24H17N5O4S (C24 H17 N5 O4 S)

Compound Name

6-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-7-[(pyridin-4-yl)methyl]-2H,7H,8H-[1,3]dioxolo[4,5-g]quinazolin-8-one

IUPAC name

6-{[(3-phenyl-124-oxadiazol-5-yl)methyl]sulfanyl}-7-[(pyridin-4-yl)methyl]-2H7H8H-[13]dioxolo[45-g]quinazolin-8-one

SMILES

O=C1N(Cc2ccncc2)C(SCc2nc(-c3ccccc3)no2)=Nc2c1cc1OCOc1c2

InChI

InChI=1S/C24H17N5O4S/c30-23-17-10-19-20(32-14-31-19)11-18(17)26-24(29(23)12-15-6-8-25-9-7-15)34-13-21-27-22(28-33-21)16-4-2-1-3-5-16/h1-11H,12-14H2

InChI Key

ZJOKRKXSJOULAT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27461126

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.5

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.420

Distribution Coefficient, logD

4.419

Water Solubility, LogSw

-4.36

Polar Surface Area

83.658

Acid Dissociation Constant (pKa)

32.09

Base Dissociation Constant (pKb)

4.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

L541-0833 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with L541-0833 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L541-0833?
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What is the minimum amount of L541-0833 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L541-0833
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L541-0833
  • 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 L541-0833 available by request