G858-0296 Screening compound: 2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide

G858-0296 Screening compound: 2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
G858-0296 Screening compound: 2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G858-0296
2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide

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

G858-0296

Molecular Formula

C26H24FN3O4S (C26 H24 FN3 O4 S)

Compound Name

2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide

IUPAC name

2-{[(3-fluorophenyl)methyl]sulfanyl}-N-(2-methoxyethyl)-3-(3-methoxyphenyl)-4-oxo-34-dihydroquinazoline-7-carboxamide

SMILES

COCCNC(c(cc1)cc(N=C(N2c3cc(OC)ccc3)SCc3cc(F)ccc3)c1C2=O)=O

InChI

InChI=1S/C26H24FN3O4S/c1-33-12-11-28-24(31)18-9-10-22-23(14-18)29-26(35-16-17-5-3-6-19(27)13-17)30(25(22)32)20-7-4-8-21(15-20)34-2/h3-10,13-15H,11-12,16H2,1-2H3,(H,28,31)

InChI Key

HFUVRRDAYGOKHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15041691

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

493.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.773

Distribution Coefficient, logD

3.773

Water Solubility, LogSw

-4.05

Polar Surface Area

65.572

Acid Dissociation Constant (pKa)

12.88

Base Dissociation Constant (pKb)

3.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

References: we are preparing a list of scientific research reports with G858-0296 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G858-0296?
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What is the minimum amount of G858-0296 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G858-0296
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G858-0296
  • 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 G858-0296 available by request