F365-0065 Screening compound: N-[(2-chlorophenyl)methyl]-2-[4-(3-methylbutyl)-1,5-dioxo-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl]acetamide

F365-0065 Screening compound: N-[(2-chlorophenyl)methyl]-2-[4-(3-methylbutyl)-1,5-dioxo-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl]acetamide
F365-0065 Screening compound: N-[(2-chlorophenyl)methyl]-2-[4-(3-methylbutyl)-1,5-dioxo-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F365-0065
N-[(2-chlorophenyl)methyl]-2-[4-(3-methylbutyl)-1,5-dioxo-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl]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

F365-0065

Molecular Formula

C23H24ClN5O3 (C23 H24 ClN5 O3)

Compound Name

N-[(2-chlorophenyl)methyl]-2-[4-(3-methylbutyl)-1,5-dioxo-1H,2H,4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-2-yl]acetamide

IUPAC name

N-[(2-chlorophenyl)methyl]-2-[4-(3-methylbutyl)-15-dioxo-1H2H4H5H-[124]triazolo[43-a]quinazolin-2-yl]acetamide

SMILES

CC(C)CCN(C(N1c2c3cccc2)=NN(CC(NCc(cccc2)c2Cl)=O)C1=O)C3=O

InChI

InChI=1S/C23H24ClN5O3/c1-15(2)11-12-27-21(31)17-8-4-6-10-19(17)29-22(27)26-28(23(29)32)14-20(30)25-13-16-7-3-5-9-18(16)24/h3-10,15H,11-14H2,1-2H3,(H,25,30)

InChI Key

NFXHCSUZWCQZEB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27119303

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

453.93

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.944

Distribution Coefficient, logD

3.944

Water Solubility, LogSw

-4.25

Polar Surface Area

72.657

Acid Dissociation Constant (pKa)

13.73

Base Dissociation Constant (pKb)

-1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

F365-0065 in Drug Discovery

Included in Screening Libraries

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

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F365-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F365-0065?
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What is the minimum amount of F365-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F365-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F365-0065
  • 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 F365-0065 available by request