Y205-3618 Screening compound: N~4~-benzyl-N~4~-phenylisonicotinamide

Y205-3618 Screening compound: N~4~-benzyl-N~4~-phenylisonicotinamide
Y205-3618 Screening compound: N~4~-benzyl-N~4~-phenylisonicotinamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y205-3618
N~4~-benzyl-N~4~-phenylisonicotinamide

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

Y205-3618

Molecular Formula

C19H16N2O (C19 H16 N2 O)

Compound Name

N~4~-benzyl-N~4~-phenylisonicotinamide

IUPAC name

N-benzyl-N-phenylpyridine-4-carboxamide

SMILES

O=C(c1ccncc1)N(Cc1ccccc1)c1ccccc1

InChI

InChI=1S/C19H16N2O/c22-19(17-11-13-20-14-12-17)21(18-9-5-2-6-10-18)15-16-7-3-1-4-8-16/h1-14H,15H2

InChI Key

NWPIKAHWPNWLIG-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.35

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.336

Distribution Coefficient, logD

3.335

Water Solubility, LogSw

-3.23

Polar Surface Area

25.018

Acid Dissociation Constant (pKa)

26.33

Base Dissociation Constant (pKb)

3.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.26

Y205-3618 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y205-3618 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y205-3618?
Check Price and Availability of Y205-3618, 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 Y205-3618 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y205-3618
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y205-3618
  • 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 Y205-3618 available by request