C301-2575 Screening compound: 1-(4-benzylpiperidin-1-yl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-ol

C301-2575 Screening compound: 1-(4-benzylpiperidin-1-yl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-ol
C301-2575 Screening compound: 1-(4-benzylpiperidin-1-yl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound C301-2575
1-(4-benzylpiperidin-1-yl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-ol

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

C301-2575

Molecular Formula

C26H34F3N3O (C26 H34 F3 N3 O)

Compound Name

1-(4-benzylpiperidin-1-yl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-ol

IUPAC name

1-(4-benzylpiperidin-1-yl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propan-2-ol

SMILES

OC(CN1CCC(Cc2ccccc2)CC1)CN(CC1)CCN1c1cccc(C(F)(F)F)c1

InChI

InChI=1S/C26H34F3N3O/c27-26(28,29)23-7-4-8-24(18-23)32-15-13-31(14-16-32)20-25(33)19-30-11-9-22(10-12-30)17-21-5-2-1-3-6-21/h1-8,18,22,25,33H,9-17,19-20H2/t25-/m0/s1

InChI Key

YHKPPRDMEUBZLB-VWLOTQADSA-N

MDL Number (MFCD)

MFCD14742657

Chemical and Physical Properties

Saltdata

2HCl

Molecular Weight

461.57

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.748

Distribution Coefficient, logD

4.319

Water Solubility, LogSw

-4.71

Polar Surface Area

27.583

Acid Dissociation Constant (pKa)

16.05

Base Dissociation Constant (pKb)

7.63

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.80

C301-2575 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

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

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

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

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Nervous system
Targets:
  • GPCR
  • GPCR
  • Ion Channels
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C301-2575 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C301-2575?
Check Price and Availability of C301-2575, 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 C301-2575 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C301-2575
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C301-2575
  • 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 C301-2575 available by request