Y205-4261 Screening compound: (2-bromophenyl)(4-cyclohexylpiperazino)methanone

Y205-4261 Screening compound: (2-bromophenyl)(4-cyclohexylpiperazino)methanone
Y205-4261 Screening compound: (2-bromophenyl)(4-cyclohexylpiperazino)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound Y205-4261
(2-bromophenyl)(4-cyclohexylpiperazino)methanone

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

Y205-4261

Molecular Formula

C17H23BrN2O (C17 H23 BrN2 O)

Compound Name

(2-bromophenyl)(4-cyclohexylpiperazino)methanone

IUPAC name

1-(2-bromobenzoyl)-4-cyclohexylpiperazine

SMILES

O=C(c(cccc1)c1Br)N(CC1)CCN1C1CCCCC1

InChI

InChI=1S/C17H23BrN2O/c18-16-9-5-4-8-15(16)17(21)20-12-10-19(11-13-20)14-6-2-1-3-7-14/h4-5,8-9,14H,1-3,6-7,10-13H2

InChI Key

LQAPDHRJIOZCPY-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

351.29

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.227

Distribution Coefficient, logD

3.064

Water Solubility, LogSw

-3.50

Polar Surface Area

19.980

Acid Dissociation Constant (pKa)

28.39

Base Dissociation Constant (pKb)

7.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

58.82

Y205-4261 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with Y205-4261 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y205-4261?
Check Price and Availability of Y205-4261, 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 Y205-4261 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y205-4261
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y205-4261
  • 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 Y205-4261 available by request