4333-6750 Screening compound: 2-(4-hydroxy-3-methoxyphenyl)-3-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinazolin-4-one

4333-6750 Screening compound: 2-(4-hydroxy-3-methoxyphenyl)-3-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinazolin-4-one
4333-6750 Screening compound: 2-(4-hydroxy-3-methoxyphenyl)-3-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4333-6750
2-(4-hydroxy-3-methoxyphenyl)-3-(4-methoxyphenyl)-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

4333-6750

Molecular Formula

C22H20N2O4 (C22 H20 N2 O4)

Compound Name

2-(4-hydroxy-3-methoxyphenyl)-3-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinazolin-4-one

IUPAC name

2-(4-hydroxy-3-methoxyphenyl)-3-(4-methoxyphenyl)-1234-tetrahydroquinazolin-4-one

SMILES

COc(cc1)ccc1N(C(c(cc1)cc(OC)c1O)Nc1c2cccc1)C2=O

InChI

InChI=1S/C22H20N2O4/c1-27-16-10-8-15(9-11-16)24-21(14-7-12-19(25)20(13-14)28-2)23-18-6-4-3-5-17(18)22(24)26/h3-13,21,23,25H,1-2H3/t21-/m0/s1

InChI Key

NNJJPSNZCWKPEW-NRFANRHFSA-N

MDL Number (MFCD)

MFCD02231901

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.521

Distribution Coefficient, logD

3.508

Water Solubility, LogSw

-3.50

Polar Surface Area

58.454

Acid Dissociation Constant (pKa)

8.89

Base Dissociation Constant (pKb)

-3.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

4333-6750 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antibacterial Compounds Library (13827 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with 4333-6750 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4333-6750?
Check Price and Availability of 4333-6750, 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 4333-6750 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4333-6750
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4333-6750
  • 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 4333-6750 available by request