SB13-0288 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide

SB13-0288 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide
SB13-0288 Screening compound: N-{3-[benzyl(methyl)amino]propyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB13-0288
N-{3-[benzyl(methyl)amino]propyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide

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

SB13-0288

Molecular Formula

C26H36N4O2 (C26 H36 N4 O2)

Compound Name

N-{3-[benzyl(methyl)amino]propyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide

IUPAC name

(2R3R)-N-{3-[benzyl(methyl)amino]propyl}-1-(2-methylpropyl)-6-oxo-2-(pyridin-3-yl)piperidine-3-carboxamide

SMILES

CC(C)CN([C@@H]([C@H](CC1)C(NCCCN(C)Cc2ccccc2)=O)c2cnccc2)C1=O

InChI

InChI=1S/C26H36N4O2/c1-20(2)18-30-24(31)13-12-23(25(30)22-11-7-14-27-17-22)26(32)28-15-8-16-29(3)19-21-9-5-4-6-10-21/h4-7,9-11,14,17,20,23,25H,8,12-13,15-16,18-19H2,1-3H3,(H,28,32)/t23-,25-/m1/s1

InChI Key

IEMWXZLXVGFNRE-ILBGXUMGSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.574

Distribution Coefficient, logD

1.077

Water Solubility, LogSw

-2.93

Polar Surface Area

54.339

Acid Dissociation Constant (pKa)

14.53

Base Dissociation Constant (pKb)

8.88

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

50.00

SB13-0288 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein-Protein Interaction Library (218420 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with SB13-0288 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB13-0288?
Check Price and Availability of SB13-0288, 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 SB13-0288 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB13-0288
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB13-0288
  • 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 SB13-0288 available by request