F367-0614 Screening compound: 2-({7-chloro-5-oxo-4-propyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)-N-[(4-methylphenyl)methyl]acetamide

F367-0614 Screening compound: 2-({7-chloro-5-oxo-4-propyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)-N-[(4-methylphenyl)methyl]acetamide
F367-0614 Screening compound: 2-({7-chloro-5-oxo-4-propyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)-N-[(4-methylphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F367-0614
2-({7-chloro-5-oxo-4-propyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)-N-[(4-methylphenyl)methyl]acetamide

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

F367-0614

Molecular Formula

C22H22ClN5O2S (C22 H22 ClN5 O2 S)

Compound Name

2-({7-chloro-5-oxo-4-propyl-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}sulfanyl)-N-[(4-methylphenyl)methyl]acetamide

IUPAC name

2-({7-chloro-5-oxo-4-propyl-4H5H-[124]triazolo[43-a]quinazolin-1-yl}sulfanyl)-N-[(4-methylphenyl)methyl]acetamide

SMILES

CCCN(c(n1-c(cc2)c3cc2Cl)nnc1SCC(NCc1ccc(C)cc1)=O)C3=O

InChI

InChI=1S/C22H22ClN5O2S/c1-3-10-27-20(30)17-11-16(23)8-9-18(17)28-21(27)25-26-22(28)31-13-19(29)24-12-15-6-4-14(2)5-7-15/h4-9,11H,3,10,12-13H2,1-2H3,(H,24,29)

InChI Key

NNNGPBRTACINNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27119816

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.97

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.095

Distribution Coefficient, logD

4.095

Water Solubility, LogSw

-4.46

Polar Surface Area

64.033

Acid Dissociation Constant (pKa)

13.38

Base Dissociation Constant (pKb)

-0.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

F367-0614 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F367-0614 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F367-0614?
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What is the minimum amount of F367-0614 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F367-0614
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F367-0614
  • 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 F367-0614 available by request