Y030-4580 Screening compound: 2-(4-bromophenyl)-N-(butan-2-yl)acetamide

Y030-4580 Screening compound: 2-(4-bromophenyl)-N-(butan-2-yl)acetamide
Y030-4580 Screening compound: 2-(4-bromophenyl)-N-(butan-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-4580
2-(4-bromophenyl)-N-(butan-2-yl)acetamide

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

Y030-4580

Molecular Formula

C12H16BrNO (C12 H16 BrNO)

Compound Name

2-(4-bromophenyl)-N-(butan-2-yl)acetamide

IUPAC name

2-(4-bromophenyl)-N-(butan-2-yl)acetamide

SMILES

CCC(C)NC(Cc(cc1)ccc1Br)=O

InChI

InChI=1S/C12H16BrNO/c1-3-9(2)14-12(15)8-10-4-6-11(13)7-5-10/h4-7,9H,3,8H2,1-2H3,(H,14,15)/t9-/m0/s1

InChI Key

OGXLNIPBXAAGQI-VIFPVBQESA-N

MDL Number (MFCD)

MFCD02860719

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

270.17

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.949

Distribution Coefficient, logD

2.949

Water Solubility, LogSw

-3.22

Polar Surface Area

24.151

Acid Dissociation Constant (pKa)

15.32

Base Dissociation Constant (pKb)

1.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

Y030-4580 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Glucocorticoid receptors Library (4806 compounds)

Soluble Diversity Library (15920 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
  • Phosphatases
Mechanism of action:
  • Receptor's ligands
  • Epigenetic
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y030-4580 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-4580?
Check Price and Availability of Y030-4580, 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 Y030-4580 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-4580
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-4580
  • 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 Y030-4580 available by request