G858-0510 Screening compound: 3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3,4-dihydroquinazolin-4-one

G858-0510 Screening compound: 3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3,4-dihydroquinazolin-4-one
G858-0510 Screening compound: 3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G858-0510
3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-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

G858-0510

Molecular Formula

C26H21FN4O5S (C26 H21 FN4 O5 S)

Compound Name

3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-3,4-dihydroquinazolin-4-one

IUPAC name

3-(4-fluorophenyl)-7-(morpholine-4-carbonyl)-2-{[(3-nitrophenyl)methyl]sulfanyl}-34-dihydroquinazolin-4-one

SMILES

[O-][N+](c1cccc(CSC(N2c(cc3)ccc3F)=Nc(cc(cc3)C(N4CCOCC4)=O)c3C2=O)c1)=O

InChI

InChI=1S/C26H21FN4O5S/c27-19-5-7-20(8-6-19)30-25(33)22-9-4-18(24(32)29-10-12-36-13-11-29)15-23(22)28-26(30)37-16-17-2-1-3-21(14-17)31(34)35/h1-9,14-15H,10-13,16H2

InChI Key

RPFFRKDMCGKZRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15041838

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.058

Distribution Coefficient, logD

3.058

Water Solubility, LogSw

-3.60

Polar Surface Area

83.098

Acid Dissociation Constant (pKa)

28.82

Base Dissociation Constant (pKb)

4.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

G858-0510 in Drug Discovery

Included in Screening Libraries

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G858-0510 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G858-0510?
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What is the minimum amount of G858-0510 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G858-0510
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G858-0510
  • 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 G858-0510 available by request