G859-0359 Screening compound: N,N-diethyl-2-{[(2-fluorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide

G859-0359 Screening compound: N,N-diethyl-2-{[(2-fluorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
G859-0359 Screening compound: N,N-diethyl-2-{[(2-fluorophenyl)methyl]sulfanyl}-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G859-0359
N,N-diethyl-2-{[(2-fluorophenyl)methyl]sulfanyl}-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

G859-0359

Molecular Formula

C27H26FN3O3S (C27 H26 FN3 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC)C(c(cc1)cc(N=C(N2c3cc(OC)ccc3)SCc(cccc3)c3F)c1C2=O)=O

InChI

InChI=1S/C27H26FN3O3S/c1-4-30(5-2)25(32)18-13-14-22-24(15-18)29-27(35-17-19-9-6-7-12-23(19)28)31(26(22)33)20-10-8-11-21(16-20)34-3/h6-16H,4-5,17H2,1-3H3

InChI Key

PROOGAWXPMVSSR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15042102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.426

Distribution Coefficient, logD

4.426

Water Solubility, LogSw

-4.38

Polar Surface Area

48.635

Acid Dissociation Constant (pKa)

29.11

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with G859-0359 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G859-0359?
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What is the minimum amount of G859-0359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G859-0359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G859-0359
  • 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 G859-0359 available by request