K284-0125 Screening compound: 3-(2-methoxybenzyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone

K284-0125 Screening compound: 3-(2-methoxybenzyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone
K284-0125 Screening compound: 3-(2-methoxybenzyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone alternative view

Chemical Structure Depiction of ChemDiv screening compound K284-0125
3-(2-methoxybenzyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone

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

K284-0125

Molecular Formula

C16H14N2O2S (C16 H14 N2 O2 S)

Compound Name

3-(2-methoxybenzyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone

IUPAC name

3-[(2-methoxyphenyl)methyl]-2-sulfanylidene-1234-tetrahydroquinazolin-4-one

SMILES

COc1c(CN(C(c(cccc2)c2N2)=O)C2=S)cccc1

InChI

InChI=1S/C16H14N2O2S/c1-20-14-9-5-2-6-11(14)10-18-15(19)12-7-3-4-8-13(12)17-16(18)21/h2-9H,10H2,1H3,(H,17,21)

InChI Key

VACPJKGZPPGKRO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02650871

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.411

Distribution Coefficient, logD

3.411

Water Solubility, LogSw

-3.78

Polar Surface Area

34.948

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

-9.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

K284-0125 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with K284-0125 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K284-0125?
Check Price and Availability of K284-0125, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of K284-0125 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K284-0125
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K284-0125
  • 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 K284-0125 available by request