Y044-4289 Screening compound: 4-(1H-indol-3-yl)-N~1~-[2-(2-pyridyl)ethyl]butanamide

Y044-4289 Screening compound: 4-(1H-indol-3-yl)-N~1~-[2-(2-pyridyl)ethyl]butanamide
Y044-4289 Screening compound: 4-(1H-indol-3-yl)-N~1~-[2-(2-pyridyl)ethyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y044-4289
4-(1H-indol-3-yl)-N~1~-[2-(2-pyridyl)ethyl]butanamide

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

Y044-4289

Molecular Formula

C19H21N3O (C19 H21 N3 O)

Compound Name

4-(1H-indol-3-yl)-N~1~-[2-(2-pyridyl)ethyl]butanamide

IUPAC name

4-(1H-indol-3-yl)-N-[2-(pyridin-2-yl)ethyl]butanamide

SMILES

O=C(CCCc1c[nH]c2c1cccc2)NCCc1ncccc1

InChI

InChI=1S/C19H21N3O/c23-19(21-13-11-16-7-3-4-12-20-16)10-5-6-15-14-22-18-9-2-1-8-17(15)18/h1-4,7-9,12,14,22H,5-6,10-11,13H2,(H,21,23)

InChI Key

FBGKLCPJOLHDME-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.155

Distribution Coefficient, logD

2.150

Water Solubility, LogSw

-2.56

Polar Surface Area

43.694

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

5.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.32

Y044-4289 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 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:
  • Nervous system
  • 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 Y044-4289 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y044-4289?
Check Price and Availability of Y044-4289, 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 Y044-4289 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y044-4289
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y044-4289
  • 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 Y044-4289 available by request