3702-0127 Screening compound: 1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methoxybenzoyl)piperazine

3702-0127 Screening compound: 1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methoxybenzoyl)piperazine
3702-0127 Screening compound: 1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methoxybenzoyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3702-0127
1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methoxybenzoyl)piperazine

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

3702-0127

Molecular Formula

C21H26N2O4 (C21 H26 N2 O4)

Compound Name

1-[(3,4-dimethoxyphenyl)methyl]-4-(4-methoxybenzoyl)piperazine

IUPAC name

1-[(34-dimethoxyphenyl)methyl]-4-(4-methoxybenzoyl)piperazine

SMILES

COc(cc1)ccc1C(N1CCN(Cc(cc2)cc(OC)c2OC)CC1)=O

InChI

InChI=1S/C21H26N2O4/c1-25-18-7-5-17(6-8-18)21(24)23-12-10-22(11-13-23)15-16-4-9-19(26-2)20(14-16)27-3/h4-9,14H,10-13,15H2,1-3H3

InChI Key

PXYNAYRCAJXUJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01540640

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

370.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.974

Distribution Coefficient, logD

1.782

Water Solubility, LogSw

-2.48

Polar Surface Area

43.232

Acid Dissociation Constant (pKa)

28.54

Base Dissociation Constant (pKb)

7.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

3702-0127 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators
  • Receptor's ligands
Targets:
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with 3702-0127 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3702-0127?
Check Price and Availability of 3702-0127, 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 3702-0127 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3702-0127
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3702-0127
  • 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 3702-0127 available by request