1682-0496 Screening compound: 2-[2-(4-methylphenoxy)acetamido]-3-phenylpropanoic acid

1682-0496 Screening compound: 2-[2-(4-methylphenoxy)acetamido]-3-phenylpropanoic acid
1682-0496 Screening compound: 2-[2-(4-methylphenoxy)acetamido]-3-phenylpropanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-0496
2-[2-(4-methylphenoxy)acetamido]-3-phenylpropanoic 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

1682-0496

Molecular Formula

C18H19NO4 (C18 H19 NO4)

Compound Name

2-[2-(4-methylphenoxy)acetamido]-3-phenylpropanoic acid

IUPAC name

2-[2-(4-methylphenoxy)acetamido]-3-phenylpropanoic acid

SMILES

Cc(cc1)ccc1OCC(NC(Cc1ccccc1)C(O)=O)=O

InChI

InChI=1S/C18H19NO4/c1-13-7-9-15(10-8-13)23-12-17(20)19-16(18(21)22)11-14-5-3-2-4-6-14/h2-10,16H,11-12H2,1H3,(H,19,20)(H,21,22)/t16-/m0/s1

InChI Key

FRCCOVWVDLDBBG-INIZCTEOSA-N

MDL Number (MFCD)

MFCD00522919

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.35

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.838

Distribution Coefficient, logD

-1.753

Water Solubility, LogSw

-1.92

Polar Surface Area

59.976

Acid Dissociation Constant (pKa)

3.81

Base Dissociation Constant (pKb)

-1.66

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

1682-0496 in Drug Discovery

Included in Screening Libraries

ACE2 Library (3043 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

CORONAVIRUS Library (20774 compounds)

NOTUM (Wnt signaling) Library (3881 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Nuclear receptors
  • Phosphatases
Agro:
  • Agro
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 1682-0496 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-0496?
Check Price and Availability of 1682-0496, 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 1682-0496 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-0496
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-0496
  • 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 1682-0496 available by request