Y030-4542 Screening compound: N-(2-methoxyphenyl)-3,3-dimethylbutanamide

Y030-4542 Screening compound: N-(2-methoxyphenyl)-3,3-dimethylbutanamide
Y030-4542 Screening compound: N-(2-methoxyphenyl)-3,3-dimethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-4542
N-(2-methoxyphenyl)-3,3-dimethylbutanamide

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

Y030-4542

Molecular Formula

C13H19NO2 (C13 H19 NO2)

Compound Name

N-(2-methoxyphenyl)-3,3-dimethylbutanamide

IUPAC name

N-(2-methoxyphenyl)-33-dimethylbutanamide

SMILES

CC(C)(C)CC(Nc(cccc1)c1OC)=O

InChI

InChI=1S/C13H19NO2/c1-13(2,3)9-12(15)14-10-7-5-6-8-11(10)16-4/h5-8H,9H2,1-4H3,(H,14,15)

InChI Key

DAGSNKGJCKAPSF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02577240

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

221.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.006

Distribution Coefficient, logD

3.006

Water Solubility, LogSw

-3.36

Polar Surface Area

30.320

Acid Dissociation Constant (pKa)

10.69

Base Dissociation Constant (pKb)

1.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

Y030-4542 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Proteases
  • Phosphatases

References: we are preparing a list of scientific research reports with Y030-4542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-4542?
Check Price and Availability of Y030-4542, 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 Y030-4542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-4542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-4542
  • 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 Y030-4542 available by request