Y040-3271 Screening compound: N-[2-(5-chloro-1H-indol-3-yl)ethyl]pyridine-4-carboxamide

Y040-3271 Screening compound: N-[2-(5-chloro-1H-indol-3-yl)ethyl]pyridine-4-carboxamide
Y040-3271 Screening compound: N-[2-(5-chloro-1H-indol-3-yl)ethyl]pyridine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-3271
N-[2-(5-chloro-1H-indol-3-yl)ethyl]pyridine-4-carboxamide

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

Y040-3271

Molecular Formula

C16H14ClN3O (C16 H14 ClN3 O)

Compound Name

N-[2-(5-chloro-1H-indol-3-yl)ethyl]pyridine-4-carboxamide

IUPAC name

N-[2-(5-chloro-1H-indol-3-yl)ethyl]pyridine-4-carboxamide

SMILES

O=C(c1ccncc1)NCCc1c[nH]c(cc2)c1cc2Cl

InChI

InChI=1S/C16H14ClN3O/c17-13-1-2-15-14(9-13)12(10-20-15)5-8-19-16(21)11-3-6-18-7-4-11/h1-4,6-7,9-10,20H,5,8H2,(H,19,21)

InChI Key

FVUQVWQOQRXKMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09847771

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

299.76

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.393

Distribution Coefficient, logD

2.393

Water Solubility, LogSw

-3.48

Polar Surface Area

43.792

Acid Dissociation Constant (pKa)

12.28

Base Dissociation Constant (pKb)

4.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

Y040-3271 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Indole Derivatives (10091 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y040-3271 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-3271?
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What is the minimum amount of Y040-3271 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-3271
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-3271
  • 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 Y040-3271 available by request