R152-1905 Screening compound: 1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

R152-1905 Screening compound: 1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
R152-1905 Screening compound: 1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound R152-1905
1-(3-methoxyphenyl)-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

R152-1905

Molecular Formula

C12H13NO4 (C12 H13 NO4)

Compound Name

1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

IUPAC name

1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid

SMILES

COc1cccc(N(CC(C2)C(O)=O)C2=O)c1

InChI

InChI=1S/C12H13NO4/c1-17-10-4-2-3-9(6-10)13-7-8(12(15)16)5-11(13)14/h2-4,6,8H,5,7H2,1H3,(H,15,16)/t8-/m1/s1

InChI Key

UFHSYKGLJVRMNV-MRVPVSSYSA-N

MDL Number (MFCD)

MFCD01630406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

235.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.606

Distribution Coefficient, logD

-1.754

Water Solubility, LogSw

-1.55

Polar Surface Area

52.940

Acid Dissociation Constant (pKa)

5.04

Base Dissociation Constant (pKb)

-2.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

33.33

R152-1905 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

Cardiovascular Library (22201 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with R152-1905 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R152-1905?
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What is the minimum amount of R152-1905 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R152-1905
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R152-1905
  • 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 R152-1905 available by request