Y030-5356 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dichlorobenzamide

Y030-5356 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dichlorobenzamide
Y030-5356 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dichlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-5356
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dichlorobenzamide

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

Y030-5356

Molecular Formula

C15H11Cl2NO3 (C15 H11 Cl2 NO3)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dichlorobenzamide

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-25-dichlorobenzamide

SMILES

O=C(c(cc(cc1)Cl)c1Cl)NCc(cc1)cc2c1OCO2

InChI

InChI=1S/C15H11Cl2NO3/c16-10-2-3-12(17)11(6-10)15(19)18-7-9-1-4-13-14(5-9)21-8-20-13/h1-6H,7-8H2,(H,18,19)

InChI Key

UIRNVJCUSIPTAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02862145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.16

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.131

Distribution Coefficient, logD

4.131

Water Solubility, LogSw

-4.49

Polar Surface Area

41.767

Acid Dissociation Constant (pKa)

11.37

Base Dissociation Constant (pKb)

-3.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

Y030-5356 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y030-5356 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-5356?
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What is the minimum amount of Y030-5356 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-5356
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-5356
  • 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 Y030-5356 available by request