SA17-0205 Screening compound: N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide

SA17-0205 Screening compound: N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide
SA17-0205 Screening compound: N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA17-0205
N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-1-(2-methylpropyl)-6-oxopiperidine-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

SA17-0205

Molecular Formula

C22H35N3O2 (C22 H35 N3 O2)

Compound Name

N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide

IUPAC name

(2R3R)-N-{2-[benzyl(ethyl)amino]ethyl}-2-methyl-1-(2-methylpropyl)-6-oxopiperidine-3-carboxamide

SMILES

CCN(CCNC([C@@H](CC1)[C@H](C)N(CC(C)C)C1=O)=O)Cc1ccccc1

InChI

InChI=1S/C22H35N3O2/c1-5-24(16-19-9-7-6-8-10-19)14-13-23-22(27)20-11-12-21(26)25(18(20)4)15-17(2)3/h6-10,17-18,20H,5,11-16H2,1-4H3,(H,23,27)/t18-,20+/m0/s1

InChI Key

BHNVEIPGUCOVSJ-AZUAARDMSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.986

Distribution Coefficient, logD

2.135

Water Solubility, LogSw

-3.55

Polar Surface Area

44.276

Acid Dissociation Constant (pKa)

13.08

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

63.64

SA17-0205 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA17-0205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA17-0205?
Check Price and Availability of SA17-0205, 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 SA17-0205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA17-0205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA17-0205
  • 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 SA17-0205 available by request