C155-0685 Screening compound: N-(1-benzylpiperidin-4-yl)-3-methyl-2-[(4-methylcyclohexyl)formamido]pentanamide

C155-0685 Screening compound: N-(1-benzylpiperidin-4-yl)-3-methyl-2-[(4-methylcyclohexyl)formamido]pentanamide
C155-0685 Screening compound: N-(1-benzylpiperidin-4-yl)-3-methyl-2-[(4-methylcyclohexyl)formamido]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C155-0685
N-(1-benzylpiperidin-4-yl)-3-methyl-2-[(4-methylcyclohexyl)formamido]pentanamide

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

C155-0685

Molecular Formula

C26H41N3O2 (C26 H41 N3 O2)

Compound Name

N-(1-benzylpiperidin-4-yl)-3-methyl-2-[(4-methylcyclohexyl)formamido]pentanamide

IUPAC name

N-(1-benzylpiperidin-4-yl)-3-methyl-2-[(4-methylcyclohexyl)formamido]pentanamide

SMILES

CCC(C)C(C(NC1CCN(Cc2ccccc2)CC1)=O)NC(C1CCC(C)CC1)=O

InChI

InChI=1S/C26H41N3O2/c1-4-20(3)24(28-25(30)22-12-10-19(2)11-13-22)26(31)27-23-14-16-29(17-15-23)18-21-8-6-5-7-9-21/h5-9,19-20,22-24H,4,10-18H2,1-3H3,(H,27,31)(H,28,30)

InChI Key

SNJNEGRMALSFKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08673994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.63

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.331

Distribution Coefficient, logD

3.773

Water Solubility, LogSw

-5.17

Polar Surface Area

52.147

Acid Dissociation Constant (pKa)

13.47

Base Dissociation Constant (pKb)

8.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

69.20

C155-0685 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

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

Anti-HIV1 Library (19540 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C155-0685 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C155-0685?
Check Price and Availability of C155-0685, 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 C155-0685 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C155-0685
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C155-0685
  • 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 C155-0685 available by request