S787-0265 Screening compound: 3-{4-[(1-cyclopentylpiperidin-4-yl)methyl]phenyl}propanamide

S787-0265 Screening compound: 3-{4-[(1-cyclopentylpiperidin-4-yl)methyl]phenyl}propanamide
S787-0265 Screening compound: 3-{4-[(1-cyclopentylpiperidin-4-yl)methyl]phenyl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S787-0265
3-{4-[(1-cyclopentylpiperidin-4-yl)methyl]phenyl}propanamide

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

S787-0265

Molecular Formula

C20H30N2O (C20 H30 N2 O)

Compound Name

3-{4-[(1-cyclopentylpiperidin-4-yl)methyl]phenyl}propanamide

IUPAC name

3-{4-[(1-cyclopentylpiperidin-4-yl)methyl]phenyl}propanamide

SMILES

NC(CCc1ccc(CC(CC2)CCN2C2CCCC2)cc1)=O

InChI

InChI=1S/C20H30N2O/c21-20(23)10-9-16-5-7-17(8-6-16)15-18-11-13-22(14-12-18)19-3-1-2-4-19/h5-8,18-19H,1-4,9-15H2,(H2,21,23)

InChI Key

MAAHRJMEOJHEIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32227996

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

314.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.462

Distribution Coefficient, logD

1.031

Water Solubility, LogSw

-3.65

Polar Surface Area

37.006

Acid Dissociation Constant (pKa)

14.95

Base Dissociation Constant (pKb)

9.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

S787-0265 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Lipid Metabolism Library (9174 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
  • Metabolic
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with S787-0265 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S787-0265?
Check Price and Availability of S787-0265, 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 S787-0265 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S787-0265
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S787-0265
  • 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 S787-0265 available by request