1682-6037 Screening compound: methyl 2-[(4-methylphenyl)formamido]-3-phenylpropanoate

1682-6037 Screening compound: methyl 2-[(4-methylphenyl)formamido]-3-phenylpropanoate
1682-6037 Screening compound: methyl 2-[(4-methylphenyl)formamido]-3-phenylpropanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-6037
methyl 2-[(4-methylphenyl)formamido]-3-phenylpropanoate

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

1682-6037

Molecular Formula

C18H19NO3 (C18 H19 NO3)

Compound Name

methyl 2-[(4-methylphenyl)formamido]-3-phenylpropanoate

IUPAC name

methyl 2-[(4-methylphenyl)formamido]-3-phenylpropanoate

SMILES

Cc(cc1)ccc1C(NC(Cc1ccccc1)C(OC)=O)=O

InChI

InChI=1S/C18H19NO3/c1-13-8-10-15(11-9-13)17(20)19-16(18(21)22-2)12-14-6-4-3-5-7-14/h3-11,16H,12H2,1-2H3,(H,19,20)/t16-/m0/s1

InChI Key

PSSDDHSCEICJEX-INIZCTEOSA-N

MDL Number (MFCD)

MFCD00704228

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.940

Distribution Coefficient, logD

2.940

Water Solubility, LogSw

-3.30

Polar Surface Area

45.456

Acid Dissociation Constant (pKa)

11.63

Base Dissociation Constant (pKb)

-4.54

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

1682-6037 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-infective Library (19449 compounds)

Anticancer Library (62698 compounds)

Antiparasite Library (23996 compounds)

CORONAVIRUS Library (20774 compounds)

Cardiovascular Library (22201 compounds)

GABA Library (7115 compounds)

Integrin Receptors Targeted library (1715 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Cancer
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cardiovascular
  • Eye
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • GPCR
  • Ion Channels
  • Others
  • Proteases
Agro:
  • Agro
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 1682-6037 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-6037?
Check Price and Availability of 1682-6037, 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 1682-6037 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-6037
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-6037
  • 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 1682-6037 available by request