Y030-0363 Screening compound: 2,4-dichloro-N-(cyanomethyl)benzamide

Y030-0363 Screening compound: 2,4-dichloro-N-(cyanomethyl)benzamide
Y030-0363 Screening compound: 2,4-dichloro-N-(cyanomethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-0363
2,4-dichloro-N-(cyanomethyl)benzamide

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

Y030-0363

Molecular Formula

C9H6Cl2N2O (C9 H6 Cl2 N2 O)

Compound Name

2,4-dichloro-N-(cyanomethyl)benzamide

IUPAC name

24-dichloro-N-(cyanomethyl)benzamide

SMILES

N#CCNC(c(ccc(Cl)c1)c1Cl)=O

InChI

InChI=1S/C9H6Cl2N2O/c10-6-1-2-7(8(11)5-6)9(14)13-4-3-12/h1-2,5H,4H2,(H,13,14)

InChI Key

WEIIHWUAMKABIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01212191

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

229.06

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.434

Distribution Coefficient, logD

2.434

Water Solubility, LogSw

-3.62

Polar Surface Area

42.257

Acid Dissociation Constant (pKa)

11.95

Base Dissociation Constant (pKb)

-6.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

Y030-0363 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Covalent Inhibitors Library (7986 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with Y030-0363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-0363?
Check Price and Availability of Y030-0363, 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 Y030-0363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-0363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-0363
  • 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 Y030-0363 available by request