Y300-3829 Screening compound: 1-(4-ethylpiperazin-1-yl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)ethan-1-one

Y300-3829 Screening compound: 1-(4-ethylpiperazin-1-yl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)ethan-1-one
Y300-3829 Screening compound: 1-(4-ethylpiperazin-1-yl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound Y300-3829
1-(4-ethylpiperazin-1-yl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)ethan-1-one

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

Y300-3829

Molecular Formula

C18H26N2O2 (C18 H26 N2 O2)

Compound Name

1-(4-ethylpiperazin-1-yl)-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)ethan-1-one

IUPAC name

1-(4-ethylpiperazin-1-yl)-2-(5678-tetrahydronaphthalen-1-yloxy)ethan-1-one

SMILES

CCN(CC1)CCN1C(COc1c(CCCC2)c2ccc1)=O

InChI

InChI=1S/C18H26N2O2/c1-2-19-10-12-20(13-11-19)18(21)14-22-17-9-5-7-15-6-3-4-8-16(15)17/h5,7,9H,2-4,6,8,10-14H2,1H3

InChI Key

JFQLNGCZJNNTHH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD28122493

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

302.42

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.286

Distribution Coefficient, logD

2.008

Water Solubility, LogSw

-2.30

Polar Surface Area

27.402

Acid Dissociation Constant (pKa)

25.23

Base Dissociation Constant (pKb)

7.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

61.10

Y300-3829 in Drug Discovery

Included in Screening Libraries

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

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Cardiovascular Library (22201 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
  • Ion Channels

References: we are preparing a list of scientific research reports with Y300-3829 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y300-3829?
Check Price and Availability of Y300-3829, 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 Y300-3829 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y300-3829
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y300-3829
  • 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 Y300-3829 available by request