4333-0025 Screening compound: 2-(2,4-dimethoxyphenyl)-3-propyl-1,2,3,4-tetrahydroquinazolin-4-one

4333-0025 Screening compound: 2-(2,4-dimethoxyphenyl)-3-propyl-1,2,3,4-tetrahydroquinazolin-4-one
4333-0025 Screening compound: 2-(2,4-dimethoxyphenyl)-3-propyl-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4333-0025
2-(2,4-dimethoxyphenyl)-3-propyl-1,2,3,4-tetrahydroquinazolin-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

4333-0025

Molecular Formula

C19H22N2O3 (C19 H22 N2 O3)

Compound Name

2-(2,4-dimethoxyphenyl)-3-propyl-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

2-(24-dimethoxyphenyl)-3-propyl-1234-tetrahydroquinazolin-4-one

SMILES

CCCN(C(c(ccc(OC)c1)c1OC)Nc1c2cccc1)C2=O

InChI

InChI=1S/C19H22N2O3/c1-4-11-21-18(15-10-9-13(23-2)12-17(15)24-3)20-16-8-6-5-7-14(16)19(21)22/h5-10,12,18,20H,4,11H2,1-3H3/t18-/m0/s1

InChI Key

LPYJMGCDGWUASB-SFHVURJKSA-N

MDL Number (MFCD)

MFCD02577316

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.4

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.739

Distribution Coefficient, logD

3.739

Water Solubility, LogSw

-3.98

Polar Surface Area

42.767

Acid Dissociation Constant (pKa)

16.87

Base Dissociation Constant (pKb)

-3.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.60

4333-0025 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4333-0025 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4333-0025?
Check Price and Availability of 4333-0025, 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 4333-0025 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4333-0025
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4333-0025
  • 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 4333-0025 available by request