Y040-3186 Screening compound: 2-acetyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]benzamide

Y040-3186 Screening compound: 2-acetyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]benzamide
Y040-3186 Screening compound: 2-acetyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-3186
2-acetyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]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

Y040-3186

Molecular Formula

C19H17ClN2O2 (C19 H17 ClN2 O2)

Compound Name

2-acetyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]benzamide

IUPAC name

2-acetyl-N-[2-(5-chloro-1H-indol-3-yl)ethyl]benzamide

SMILES

CC(c(cccc1)c1C(NCCc1c[nH]c(cc2)c1cc2Cl)=O)=O

InChI

InChI=1S/C19H17ClN2O2/c1-12(23)15-4-2-3-5-16(15)19(24)21-9-8-13-11-22-18-7-6-14(20)10-17(13)18/h2-7,10-11,22H,8-9H2,1H3,(H,21,24)

InChI Key

UJXQUMJIJYVRBN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08743958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.81

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.399

Distribution Coefficient, logD

3.399

Water Solubility, LogSw

-4.01

Polar Surface Area

48.191

Acid Dissociation Constant (pKa)

11.42

Base Dissociation Constant (pKb)

-2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

Y040-3186 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Indole Derivatives (10091 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Structure:
  • Cyclic compounds
Targets:
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with Y040-3186 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-3186?
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What is the minimum amount of Y040-3186 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-3186
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-3186
  • 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 Y040-3186 available by request