8003-4319 Screening compound: methyl 3-[(4-acetylphenyl)carbamoyl]propanoate

8003-4319 Screening compound: methyl 3-[(4-acetylphenyl)carbamoyl]propanoate
8003-4319 Screening compound: methyl 3-[(4-acetylphenyl)carbamoyl]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8003-4319
methyl 3-[(4-acetylphenyl)carbamoyl]propanoate

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

8003-4319

Molecular Formula

C13H15NO4 (C13 H15 NO4)

Compound Name

methyl 3-[(4-acetylphenyl)carbamoyl]propanoate

IUPAC name

methyl 3-[(4-acetylphenyl)carbamoyl]propanoate

SMILES

CC(c(cc1)ccc1NC(CCC(OC)=O)=O)=O

InChI

InChI=1S/C13H15NO4/c1-9(15)10-3-5-11(6-4-10)14-12(16)7-8-13(17)18-2/h3-6H,7-8H2,1-2H3,(H,14,16)

InChI Key

FSGPLFFTRCTCFQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00441135

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

249.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.893

Distribution Coefficient, logD

0.893

Water Solubility, LogSw

-1.73

Polar Surface Area

57.793

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

-1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

8003-4319 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Proteases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8003-4319 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8003-4319?
Check Price and Availability of 8003-4319, 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 8003-4319 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8003-4319
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8003-4319
  • 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 8003-4319 available by request