G859-0079 Screening compound: 2-(benzylsulfanyl)-3-(3-fluorophenyl)-7-(morpholine-4-carbonyl)-3,4-dihydroquinazolin-4-one

G859-0079 Screening compound: 2-(benzylsulfanyl)-3-(3-fluorophenyl)-7-(morpholine-4-carbonyl)-3,4-dihydroquinazolin-4-one
G859-0079 Screening compound: 2-(benzylsulfanyl)-3-(3-fluorophenyl)-7-(morpholine-4-carbonyl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G859-0079
2-(benzylsulfanyl)-3-(3-fluorophenyl)-7-(morpholine-4-carbonyl)-3,4-dihydroquinazolin-4-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

G859-0079

Molecular Formula

C26H22FN3O3S (C26 H22 FN3 O3 S)

Compound Name

2-(benzylsulfanyl)-3-(3-fluorophenyl)-7-(morpholine-4-carbonyl)-3,4-dihydroquinazolin-4-one

IUPAC name

2-(benzylsulfanyl)-3-(3-fluorophenyl)-7-(morpholine-4-carbonyl)-34-dihydroquinazolin-4-one

SMILES

O=C(c(cc1)cc(N=C(N2c3cc(F)ccc3)SCc3ccccc3)c1C2=O)N1CCOCC1

InChI

InChI=1S/C26H22FN3O3S/c27-20-7-4-8-21(16-20)30-25(32)22-10-9-19(24(31)29-11-13-33-14-12-29)15-23(22)28-26(30)34-17-18-5-2-1-3-6-18/h1-10,15-16H,11-14,17H2

InChI Key

REHGIRUWGMILPT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15041919

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.965

Distribution Coefficient, logD

2.964

Water Solubility, LogSw

-3.57

Polar Surface Area

49.716

Acid Dissociation Constant (pKa)

28.82

Base Dissociation Constant (pKb)

3.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

G859-0079 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G859-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G859-0079?
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What is the minimum amount of G859-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G859-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G859-0079
  • 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 G859-0079 available by request