3966-1059 Screening compound: 2-(ethylsulfanyl)-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one

3966-1059 Screening compound: 2-(ethylsulfanyl)-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one
3966-1059 Screening compound: 2-(ethylsulfanyl)-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3966-1059
2-(ethylsulfanyl)-3-(3-methoxyphenyl)-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

3966-1059

Molecular Formula

C17H16N2O2S (C17 H16 N2 O2 S)

Compound Name

2-(ethylsulfanyl)-3-(3-methoxyphenyl)-3,4-dihydroquinazolin-4-one

IUPAC name

2-(ethylsulfanyl)-3-(3-methoxyphenyl)-34-dihydroquinazolin-4-one

SMILES

CCSC(N1c2cc(OC)ccc2)=Nc(cccc2)c2C1=O

InChI

InChI=1S/C17H16N2O2S/c1-3-22-17-18-15-10-5-4-9-14(15)16(20)19(17)12-7-6-8-13(11-12)21-2/h4-11H,3H2,1-2H3

InChI Key

JBUQNODYIZMFIO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01992734

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

312.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.326

Distribution Coefficient, logD

3.326

Water Solubility, LogSw

-3.80

Polar Surface Area

32.975

Acid Dissociation Constant (pKa)

30.32

Base Dissociation Constant (pKb)

3.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

3966-1059 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 3966-1059 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3966-1059?
Check Price and Availability of 3966-1059, 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 3966-1059 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3966-1059
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3966-1059
  • 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 3966-1059 available by request