SA17-0095 Screening compound: N-[2-(2,4-dimethoxyphenyl)ethyl]-1-(2-methoxyethyl)-2-methyl-6-oxopiperidine-3-carboxamide

SA17-0095 Screening compound: N-[2-(2,4-dimethoxyphenyl)ethyl]-1-(2-methoxyethyl)-2-methyl-6-oxopiperidine-3-carboxamide
SA17-0095 Screening compound: N-[2-(2,4-dimethoxyphenyl)ethyl]-1-(2-methoxyethyl)-2-methyl-6-oxopiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA17-0095
N-[2-(2,4-dimethoxyphenyl)ethyl]-1-(2-methoxyethyl)-2-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

SA17-0095

Molecular Formula

C20H30N2O5 (C20 H30 N2 O5)

Compound Name

N-[2-(2,4-dimethoxyphenyl)ethyl]-1-(2-methoxyethyl)-2-methyl-6-oxopiperidine-3-carboxamide

IUPAC name

(2R3R)-N-[2-(24-dimethoxyphenyl)ethyl]-1-(2-methoxyethyl)-2-methyl-6-oxopiperidine-3-carboxamide

SMILES

C[C@@H]([C@H](CC1)C(NCCc(ccc(OC)c2)c2OC)=O)N(CCOC)C1=O

InChI

InChI=1S/C20H30N2O5/c1-14-17(7-8-19(23)22(14)11-12-25-2)20(24)21-10-9-15-5-6-16(26-3)13-18(15)27-4/h5-6,13-14,17H,7-12H2,1-4H3,(H,21,24)/t14-,17+/m0/s1

InChI Key

ULQQJHKCJPHSCV-WMLDXEAASA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.658

Distribution Coefficient, logD

1.658

Water Solubility, LogSw

-2.63

Polar Surface Area

64.084

Acid Dissociation Constant (pKa)

13.67

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

60.00

SA17-0095 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA17-0095 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA17-0095?
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What is the minimum amount of SA17-0095 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA17-0095
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA17-0095
  • 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 SA17-0095 available by request