S760-0213 Screening compound: N-(1-benzylpiperidin-4-yl)-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide

S760-0213 Screening compound: N-(1-benzylpiperidin-4-yl)-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide
S760-0213 Screening compound: N-(1-benzylpiperidin-4-yl)-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S760-0213
N-(1-benzylpiperidin-4-yl)-2-(methoxymethyl)-1-methyl-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

S760-0213

Molecular Formula

C21H31N3O3 (C21 H31 N3 O3)

Compound Name

N-(1-benzylpiperidin-4-yl)-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide

IUPAC name

(2S3R)-N-(1-benzylpiperidin-4-yl)-2-(methoxymethyl)-1-methyl-6-oxopiperidine-3-carboxamide

SMILES

CN([C@@H](COC)[C@H](CC1)C(NC2CCN(Cc3ccccc3)CC2)=O)C1=O

InChI

InChI=1S/C21H31N3O3/c1-23-19(15-27-2)18(8-9-20(23)25)21(26)22-17-10-12-24(13-11-17)14-16-6-4-3-5-7-16/h3-7,17-19H,8-15H2,1-2H3,(H,22,26)/t18-,19+/m1/s1

InChI Key

LZJVNIUOHGMZBJ-MOPGFXCFSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.865

Distribution Coefficient, logD

-0.692

Water Solubility, LogSw

-2.36

Polar Surface Area

52.564

Acid Dissociation Constant (pKa)

15.43

Base Dissociation Constant (pKb)

8.95

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

61.90

S760-0213 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

Anti-HIV1 Library (19540 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with S760-0213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S760-0213?
Check Price and Availability of S760-0213, 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 S760-0213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S760-0213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S760-0213
  • 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 S760-0213 available by request