1473-0572 Screening compound: methyl 4-(phenylcarbamoyl)butanoate

1473-0572 Screening compound: methyl 4-(phenylcarbamoyl)butanoate
1473-0572 Screening compound: methyl 4-(phenylcarbamoyl)butanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1473-0572
methyl 4-(phenylcarbamoyl)butanoate

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

1473-0572

Molecular Formula

C12H15NO3 (C12 H15 NO3)

Compound Name

methyl 4-(phenylcarbamoyl)butanoate

IUPAC name

methyl 4-(phenylcarbamoyl)butanoate

SMILES

COC(CCCC(Nc1ccccc1)=O)=O

InChI

InChI=1S/C12H15NO3/c1-16-12(15)9-5-8-11(14)13-10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3,(H,13,14)

InChI Key

FUHOJUMIOGEEHL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00448102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

221.26

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

1.267

Distribution Coefficient, logD

1.267

Water Solubility, LogSw

-1.79

Polar Surface Area

43.967

Acid Dissociation Constant (pKa)

12.52

Base Dissociation Constant (pKb)

2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

1473-0572 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Soluble Diversity Library (15920 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 1473-0572 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1473-0572?
Check Price and Availability of 1473-0572, 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 1473-0572 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1473-0572
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1473-0572
  • 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 1473-0572 available by request