3381-0378 Screening compound: 1-[(2-METHOXYPHENYL)METHYL]-4-(PYRIDINE-4-CARBONYL)PIPERAZINE

3381-0378 Screening compound: 1-[(2-METHOXYPHENYL)METHYL]-4-(PYRIDINE-4-CARBONYL)PIPERAZINE
3381-0378 Screening compound: 1-[(2-METHOXYPHENYL)METHYL]-4-(PYRIDINE-4-CARBONYL)PIPERAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3381-0378
1-[(2-METHOXYPHENYL)METHYL]-4-(PYRIDINE-4-CARBONYL)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

3381-0378

Molecular Formula

C18H21N3O2 (C18 H21 N3 O2)

Compound Name

1-[(2-METHOXYPHENYL)METHYL]-4-(PYRIDINE-4-CARBONYL)PIPERAZINE

IUPAC name

n/a

SMILES

COc1c(CN(CC2)CCN2C(c2ccncc2)=O)cccc1

InChI

InChI=1S/C18H21N3O2/c1-23-17-5-3-2-4-16(17)14-20-10-12-21(13-11-20)18(22)15-6-8-19-9-7-15/h2-9H,10-14H2,1H3

InChI Key

NBHRMMLXTUXRIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01816530

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

311.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.275

Distribution Coefficient, logD

1.259

Water Solubility, LogSw

-1.42

Polar Surface Area

37.486

Acid Dissociation Constant (pKa)

28.11

Base Dissociation Constant (pKb)

5.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

3381-0378 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3381-0378 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3381-0378?
Check Price and Availability of 3381-0378, 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 3381-0378 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3381-0378
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3381-0378
  • 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 3381-0378 available by request