C138-0210 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-N-(3-methoxypropyl)-6-oxopiperidine-3-carboxamide

C138-0210 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-N-(3-methoxypropyl)-6-oxopiperidine-3-carboxamide
C138-0210 Screening compound: 1-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-N-(3-methoxypropyl)-6-oxopiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C138-0210
1-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-N-(3-methoxypropyl)-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

C138-0210

Molecular Formula

C24H28N2O6 (C24 H28 N2 O6)

Compound Name

1-(2H-1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-N-(3-methoxypropyl)-6-oxopiperidine-3-carboxamide

IUPAC name

1-(2H-13-benzodioxol-5-yl)-2-(4-methoxyphenyl)-N-(3-methoxypropyl)-6-oxopiperidine-3-carboxamide

SMILES

COCCCNC(C(CCC1=O)C(c(cc2)ccc2OC)N1c(cc1)cc2c1OCO2)=O

InChI

InChI=1S/C24H28N2O6/c1-29-13-3-12-25-24(28)19-9-11-22(27)26(17-6-10-20-21(14-17)32-15-31-20)23(19)16-4-7-18(30-2)8-5-16/h4-8,10,14,19,23H,3,9,11-13,15H2,1-2H3,(H,25,28)

InChI Key

JXZWNAGOCCSQLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14721949

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.5

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.610

Distribution Coefficient, logD

2.610

Water Solubility, LogSw

-3.45

Polar Surface Area

73.117

Acid Dissociation Constant (pKa)

13.86

Base Dissociation Constant (pKb)

-0.70

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

41.70

C138-0210 in Drug Discovery

Included in Screening Libraries

BRD4 Targeted Library (4534 compounds)

Dark Chemical Matter Library (18430 compounds)

SmartTM Library (51161 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Hemic and lymphatic
  • Cardiovascular
  • Metabolic
  • Cancer
Targets:
  • Others
Structure:
  • Pool
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with C138-0210 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C138-0210?
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What is the minimum amount of C138-0210 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C138-0210
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C138-0210
  • 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 C138-0210 available by request