Y031-9893 Screening compound: 4-(acetylamino)-N-(3-pyridylmethyl)benzamide

Y031-9893 Screening compound: 4-(acetylamino)-N-(3-pyridylmethyl)benzamide
Y031-9893 Screening compound: 4-(acetylamino)-N-(3-pyridylmethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-9893
4-(acetylamino)-N-(3-pyridylmethyl)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

Y031-9893

Molecular Formula

C15H15N3O2 (C15 H15 N3 O2)

Compound Name

4-(acetylamino)-N-(3-pyridylmethyl)benzamide

IUPAC name

4-acetamido-N-[(pyridin-3-yl)methyl]benzamide

SMILES

CC(Nc(cc1)ccc1C(NCc1cnccc1)=O)=O

InChI

InChI=1S/C15H15N3O2/c1-11(19)18-14-6-4-13(5-7-14)15(20)17-10-12-3-2-8-16-9-12/h2-9H,10H2,1H3,(H,17,20)(H,18,19)

InChI Key

IHBQVETZJLSNMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01137041

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.660

Distribution Coefficient, logD

0.660

Water Solubility, LogSw

-1.03

Polar Surface Area

57.432

Acid Dissociation Constant (pKa)

10.78

Base Dissociation Constant (pKb)

3.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.33

Y031-9893 in Drug Discovery

Included in Screening Libraries

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Ion Channels
  • Phosphatases

References: we are preparing a list of scientific research reports with Y031-9893 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-9893?
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What is the minimum amount of Y031-9893 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-9893
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-9893
  • 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 Y031-9893 available by request