G861-0219 Screening compound: 2-butyl-6-[2-(2-chlorophenyl)-2-oxoethyl]-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-5-one

G861-0219 Screening compound: 2-butyl-6-[2-(2-chlorophenyl)-2-oxoethyl]-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-5-one
G861-0219 Screening compound: 2-butyl-6-[2-(2-chlorophenyl)-2-oxoethyl]-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G861-0219
2-butyl-6-[2-(2-chlorophenyl)-2-oxoethyl]-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-5-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

G861-0219

Molecular Formula

C21H19ClN4O2 (C21 H19 ClN4 O2)

Compound Name

2-butyl-6-[2-(2-chlorophenyl)-2-oxoethyl]-5H,6H-[1,2,4]triazolo[1,5-c]quinazolin-5-one

IUPAC name

2-butyl-6-[2-(2-chlorophenyl)-2-oxoethyl]-5H6H-[124]triazolo[15-c]quinazolin-5-one

SMILES

CCCCc(nc1-c(cccc2)c2N2CC(c(cccc3)c3Cl)=O)nn1C2=O

InChI

InChI=1S/C21H19ClN4O2/c1-2-3-12-19-23-20-15-9-5-7-11-17(15)25(21(28)26(20)24-19)13-18(27)14-8-4-6-10-16(14)22/h4-11H,2-3,12-13H2,1H3

InChI Key

OPQVIVQRALOHKL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27165007

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.86

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.368

Distribution Coefficient, logD

4.368

Water Solubility, LogSw

-4.55

Polar Surface Area

53.604

Acid Dissociation Constant (pKa)

17.68

Base Dissociation Constant (pKb)

1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.80

G861-0219 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G861-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G861-0219?
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What is the minimum amount of G861-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G861-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G861-0219
  • 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 G861-0219 available by request