R152-2104 Screening compound: 1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid

R152-2104 Screening compound: 1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid
R152-2104 Screening compound: 1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R152-2104
1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid

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

R152-2104

Molecular Formula

C14H17NO3 (C14 H17 NO3)

Compound Name

1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid

IUPAC name

1-[2-(4-methylphenyl)ethyl]-5-oxopyrrolidine-3-carboxylic acid

SMILES

Cc1ccc(CCN(CC(C2)C(O)=O)C2=O)cc1

InChI

InChI=1S/C14H17NO3/c1-10-2-4-11(5-3-10)6-7-15-9-12(14(17)18)8-13(15)16/h2-5,12H,6-9H2,1H3,(H,17,18)/t12-/m1/s1

InChI Key

ARRIDUGUVCPYMT-GFCCVEGCSA-N

MDL Number (MFCD)

MFCD15141784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

247.29

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.733

Distribution Coefficient, logD

-1.816

Water Solubility, LogSw

-1.49

Polar Surface Area

45.821

Acid Dissociation Constant (pKa)

4.85

Base Dissociation Constant (pKb)

-1.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

R152-2104 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with R152-2104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R152-2104?
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What is the minimum amount of R152-2104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R152-2104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R152-2104
  • 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 R152-2104 available by request