4444-0191 Screening compound: 1-benzoyl-2-(4-methoxyphenyl)-3-(4-methylbenzoyl)imidazolidine

4444-0191 Screening compound: 1-benzoyl-2-(4-methoxyphenyl)-3-(4-methylbenzoyl)imidazolidine
4444-0191 Screening compound: 1-benzoyl-2-(4-methoxyphenyl)-3-(4-methylbenzoyl)imidazolidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4444-0191
1-benzoyl-2-(4-methoxyphenyl)-3-(4-methylbenzoyl)imidazolidine

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

4444-0191

Molecular Formula

C25H24N2O3 (C25 H24 N2 O3)

Compound Name

1-benzoyl-2-(4-methoxyphenyl)-3-(4-methylbenzoyl)imidazolidine

IUPAC name

1-benzoyl-2-(4-methoxyphenyl)-3-(4-methylbenzoyl)imidazolidine

SMILES

Cc(cc1)ccc1C(N(CC1)C(c(cc2)ccc2OC)N1C(c1ccccc1)=O)=O

InChI

InChI=1S/C25H24N2O3/c1-18-8-10-21(11-9-18)25(29)27-17-16-26(24(28)20-6-4-3-5-7-20)23(27)19-12-14-22(30-2)15-13-19/h3-15,23H,16-17H2,1-2H3/t23-/m0/s1

InChI Key

XHXNYVGMAMVMAA-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD02973544

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.435

Distribution Coefficient, logD

4.435

Water Solubility, LogSw

-4.27

Polar Surface Area

40.122

Acid Dissociation Constant (pKa)

24.26

Base Dissociation Constant (pKb)

-7.40

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

4444-0191 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
Targets:
  • Others
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with 4444-0191 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4444-0191?
Check Price and Availability of 4444-0191, 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 4444-0191 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4444-0191
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4444-0191
  • 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 4444-0191 available by request