Y206-5035 Screening compound: 2-[4-(2-methylphenyl)piperazino]-N~1~-phenethylacetamide

Y206-5035 Screening compound: 2-[4-(2-methylphenyl)piperazino]-N~1~-phenethylacetamide
Y206-5035 Screening compound: 2-[4-(2-methylphenyl)piperazino]-N~1~-phenethylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y206-5035
2-[4-(2-methylphenyl)piperazino]-N~1~-phenethylacetamide

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

Y206-5035

Molecular Formula

C21H27N3O (C21 H27 N3 O)

Compound Name

2-[4-(2-methylphenyl)piperazino]-N~1~-phenethylacetamide

IUPAC name

2-[4-(2-methylphenyl)piperazin-1-yl]-N-(2-phenylethyl)acetamide

SMILES

Cc(cccc1)c1N1CCN(CC(NCCc2ccccc2)=O)CC1

InChI

InChI=1S/C21H27N3O/c1-18-7-5-6-10-20(18)24-15-13-23(14-16-24)17-21(25)22-12-11-19-8-3-2-4-9-19/h2-10H,11-17H2,1H3,(H,22,25)

InChI Key

DWMSDCCNWIPKEK-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.46

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.299

Distribution Coefficient, logD

3.287

Water Solubility, LogSw

-3.38

Polar Surface Area

31.243

Acid Dissociation Constant (pKa)

14.44

Base Dissociation Constant (pKb)

5.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

Y206-5035 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)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with Y206-5035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y206-5035?
Check Price and Availability of Y206-5035, 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 Y206-5035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y206-5035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y206-5035
  • 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 Y206-5035 available by request