3381-0372 Screening compound: 1-[(2-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine

3381-0372 Screening compound: 1-[(2-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine
3381-0372 Screening compound: 1-[(2-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3381-0372
1-[(2-bromophenyl)methyl]-4-(furan-2-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

3381-0372

Molecular Formula

C16H17BrN2O2 (C16 H17 BrN2 O2)

Compound Name

1-[(2-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine

IUPAC name

1-[(2-bromophenyl)methyl]-4-(furan-2-carbonyl)piperazine

SMILES

O=C(c1ccco1)N1CCN(Cc(cccc2)c2Br)CC1

InChI

InChI=1S/C16H17BrN2O2/c17-14-5-2-1-4-13(14)12-18-7-9-19(10-8-18)16(20)15-6-3-11-21-15/h1-6,11H,7-10,12H2

InChI Key

VGSNSJJNUBWZTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01816528

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

349.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.592

Distribution Coefficient, logD

2.587

Water Solubility, LogSw

-2.60

Polar Surface Area

29.006

Acid Dissociation Constant (pKa)

28.69

Base Dissociation Constant (pKb)

5.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

3381-0372 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 3381-0372 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3381-0372?
Check Price and Availability of 3381-0372, 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 3381-0372 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3381-0372
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3381-0372
  • 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 3381-0372 available by request