Y030-4784 Screening compound: N-(3-chloro-2-methylphenyl)-2,2-dimethylbutanamide

Y030-4784 Screening compound: N-(3-chloro-2-methylphenyl)-2,2-dimethylbutanamide
Y030-4784 Screening compound: N-(3-chloro-2-methylphenyl)-2,2-dimethylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-4784
N-(3-chloro-2-methylphenyl)-2,2-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

Y030-4784

Molecular Formula

C13H18ClNO (C13 H18 ClNO)

Compound Name

N-(3-chloro-2-methylphenyl)-2,2-dimethylbutanamide

IUPAC name

N-(3-chloro-2-methylphenyl)-22-dimethylbutanamide

SMILES

CCC(C)(C)C(Nc1cccc(Cl)c1C)=O

InChI

InChI=1S/C13H18ClNO/c1-5-13(3,4)12(16)15-11-8-6-7-10(14)9(11)2/h6-8H,5H2,1-4H3,(H,15,16)

InChI Key

KIPCXBLRHNWCSN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02861142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

239.74

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.477

Distribution Coefficient, logD

4.476

Water Solubility, LogSw

-4.30

Polar Surface Area

22.903

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

-0.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

Y030-4784 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic
Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y030-4784 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-4784?
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What is the minimum amount of Y030-4784 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-4784
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-4784
  • 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 Y030-4784 available by request