2328-0581 Screening compound: 3-[(2,5-dimethoxyphenyl)carbamoyl]-2-[(2-methoxyphenyl)methyl]propanoic acid

2328-0581 Screening compound: 3-[(2,5-dimethoxyphenyl)carbamoyl]-2-[(2-methoxyphenyl)methyl]propanoic acid
2328-0581 Screening compound: 3-[(2,5-dimethoxyphenyl)carbamoyl]-2-[(2-methoxyphenyl)methyl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2328-0581
3-[(2,5-dimethoxyphenyl)carbamoyl]-2-[(2-methoxyphenyl)methyl]propanoic 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

2328-0581

Molecular Formula

C20H23NO6 (C20 H23 NO6)

Compound Name

3-[(2,5-dimethoxyphenyl)carbamoyl]-2-[(2-methoxyphenyl)methyl]propanoic acid

IUPAC name

3-[(25-dimethoxyphenyl)carbamoyl]-2-[(2-methoxyphenyl)methyl]propanoic acid

SMILES

COc(cc1)cc(NC(CC(Cc(cccc2)c2OC)C(O)=O)=O)c1OC

InChI

InChI=1S/C20H23NO6/c1-25-15-8-9-18(27-3)16(12-15)21-19(22)11-14(20(23)24)10-13-6-4-5-7-17(13)26-2/h4-9,12,14H,10-11H2,1-3H3,(H,21,22)(H,23,24)/t14-/m1/s1

InChI Key

TVYNRPAAXFWNCS-CQSZACIVSA-N

MDL Number (MFCD)

MFCD01841237

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.455

Distribution Coefficient, logD

-0.199

Water Solubility, LogSw

-2.90

Polar Surface Area

73.631

Acid Dissociation Constant (pKa)

4.75

Base Dissociation Constant (pKb)

1.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.00

2328-0581 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 2328-0581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2328-0581?
Check Price and Availability of 2328-0581, 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 2328-0581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2328-0581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2328-0581
  • 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 2328-0581 available by request