F452-0172 Screening compound: 1-benzyl-4-(3,4-dimethoxyphenyl)piperidine-2,6-dione

F452-0172 Screening compound: 1-benzyl-4-(3,4-dimethoxyphenyl)piperidine-2,6-dione
F452-0172 Screening compound: 1-benzyl-4-(3,4-dimethoxyphenyl)piperidine-2,6-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound F452-0172
1-benzyl-4-(3,4-dimethoxyphenyl)piperidine-2,6-dione

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

F452-0172

Molecular Formula

C20H21NO4 (C20 H21 NO4)

Compound Name

1-benzyl-4-(3,4-dimethoxyphenyl)piperidine-2,6-dione

IUPAC name

1-benzyl-4-(34-dimethoxyphenyl)piperidine-26-dione

SMILES

COc(ccc(C(CC(N1Cc2ccccc2)=O)CC1=O)c1)c1OC

InChI

InChI=1S/C20H21NO4/c1-24-17-9-8-15(10-18(17)25-2)16-11-19(22)21(20(23)12-16)13-14-6-4-3-5-7-14/h3-10,16H,11-13H2,1-2H3

InChI Key

MMOZFEAVEUCWSJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD18172001

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

339.39

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.497

Distribution Coefficient, logD

2.497

Water Solubility, LogSw

-2.85

Polar Surface Area

44.942

Acid Dissociation Constant (pKa)

17.72

Base Dissociation Constant (pKb)

-5.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

F452-0172 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with F452-0172 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F452-0172?
Check Price and Availability of F452-0172, 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 F452-0172 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F452-0172
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F452-0172
  • 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 F452-0172 available by request