3389-1996 Screening compound: 6,7-dimethyl-4-methylidene-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one

3389-1996 Screening compound: 6,7-dimethyl-4-methylidene-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one
3389-1996 Screening compound: 6,7-dimethyl-4-methylidene-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3389-1996
6,7-dimethyl-4-methylidene-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-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

3389-1996

Molecular Formula

C17H16N2O (C17 H16 N2 O)

Compound Name

6,7-dimethyl-4-methylidene-3-phenyl-1,2,3,4-tetrahydroquinazolin-2-one

IUPAC name

67-dimethyl-4-methylidene-3-phenyl-1234-tetrahydroquinazolin-2-one

SMILES

Cc(c(C)c1)cc(C(N2c3ccccc3)=C)c1NC2=O

InChI

InChI=1S/C17H16N2O/c1-11-9-15-13(3)19(14-7-5-4-6-8-14)17(20)18-16(15)10-12(11)2/h4-10H,3H2,1-2H3,(H,18,20)

InChI Key

ORPWCBBBYPPRIJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01796339

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.33

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.106

Distribution Coefficient, logD

4.106

Water Solubility, LogSw

-4.23

Polar Surface Area

26.370

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

-2.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

3389-1996 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic

References: we are preparing a list of scientific research reports with 3389-1996 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3389-1996?
Check Price and Availability of 3389-1996, 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 3389-1996 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3389-1996
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3389-1996
  • 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 3389-1996 available by request