4092-0839 Screening compound: 1-[(4-chlorophenyl)methyl]-4-cycloheptylpiperazine

4092-0839 Screening compound: 1-[(4-chlorophenyl)methyl]-4-cycloheptylpiperazine
4092-0839 Screening compound: 1-[(4-chlorophenyl)methyl]-4-cycloheptylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4092-0839
1-[(4-chlorophenyl)methyl]-4-cycloheptylpiperazine

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

4092-0839

Molecular Formula

C18H27ClN2 (C18 H27 ClN2)

Compound Name

1-[(4-chlorophenyl)methyl]-4-cycloheptylpiperazine

IUPAC name

1-[(4-chlorophenyl)methyl]-4-cycloheptylpiperazine

SMILES

Clc1ccc(CN(CC2)CCN2C2CCCCCC2)cc1

InChI

InChI=1S/C18H27ClN2/c19-17-9-7-16(8-10-17)15-20-11-13-21(14-12-20)18-5-3-1-2-4-6-18/h7-10,18H,1-6,11-15H2

InChI Key

FQLPGRTTWAZLNW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02212934

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

306.88

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.375

Distribution Coefficient, logD

3.669

Water Solubility, LogSw

-4.52

Polar Surface Area

7.395

Acid Dissociation Constant (pKa)

28.10

Base Dissociation Constant (pKb)

8.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

66.70

4092-0839 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 4092-0839 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4092-0839?
Check Price and Availability of 4092-0839, 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 4092-0839 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4092-0839
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4092-0839
  • 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 4092-0839 available by request