8013-3898 Screening compound: 1-(3,4-dimethoxybenzoyl)-4-(4-methylphenyl)piperazine

8013-3898 Screening compound: 1-(3,4-dimethoxybenzoyl)-4-(4-methylphenyl)piperazine
8013-3898 Screening compound: 1-(3,4-dimethoxybenzoyl)-4-(4-methylphenyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-3898
1-(3,4-dimethoxybenzoyl)-4-(4-methylphenyl)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

8013-3898

Molecular Formula

C20H24N2O3 (C20 H24 N2 O3)

Compound Name

1-(3,4-dimethoxybenzoyl)-4-(4-methylphenyl)piperazine

IUPAC name

1-(34-dimethoxybenzoyl)-4-(4-methylphenyl)piperazine

SMILES

Cc(cc1)ccc1N(CC1)CCN1C(c(cc1)cc(OC)c1OC)=O

InChI

InChI=1S/C20H24N2O3/c1-15-4-7-17(8-5-15)21-10-12-22(13-11-21)20(23)16-6-9-18(24-2)19(14-16)25-3/h4-9,14H,10-13H2,1-3H3

InChI Key

DKBQCCCYGNBHDG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03766423

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.822

Distribution Coefficient, logD

2.822

Water Solubility, LogSw

-3.07

Polar Surface Area

35.408

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

6.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

8013-3898 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8013-3898 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-3898?
Check Price and Availability of 8013-3898, 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 8013-3898 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-3898
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-3898
  • 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 8013-3898 available by request