SB13-0353 Screening compound: 2-(4-fluorophenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxopiperidine-3-carboxamide

SB13-0353 Screening compound: 2-(4-fluorophenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxopiperidine-3-carboxamide
SB13-0353 Screening compound: 2-(4-fluorophenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxopiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB13-0353
2-(4-fluorophenyl)-1-(2-methoxyethyl)-N-(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

SB13-0353

Molecular Formula

C19H27FN2O3 (C19 H27 FN2 O3)

Compound Name

2-(4-fluorophenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxopiperidine-3-carboxamide

IUPAC name

(2R3R)-2-(4-fluorophenyl)-1-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxopiperidine-3-carboxamide

SMILES

CC(C)CNC([C@@H](CC1)[C@@H](c(cc2)ccc2F)N(CCOC)C1=O)=O

InChI

InChI=1S/C19H27FN2O3/c1-13(2)12-21-19(24)16-8-9-17(23)22(10-11-25-3)18(16)14-4-6-15(20)7-5-14/h4-7,13,16,18H,8-12H2,1-3H3,(H,21,24)/t16-,18+/m0/s1

InChI Key

GRTGSLQXGPZOKC-FUHWJXTLSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.264

Distribution Coefficient, logD

2.264

Water Solubility, LogSw

-3.01

Polar Surface Area

49.478

Acid Dissociation Constant (pKa)

14.80

Base Dissociation Constant (pKb)

-0.41

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

57.90

SB13-0353 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)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Mimetics
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • Epigenetic
Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic

References: we are preparing a list of scientific research reports with SB13-0353 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB13-0353?
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What is the minimum amount of SB13-0353 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB13-0353
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB13-0353
  • 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 SB13-0353 available by request