SB13-0079 Screening compound: N-(2-methoxyethyl)-2-(4-methoxyphenyl)-1-methyl-6-oxopiperidine-3-carboxamide

SB13-0079 Screening compound: N-(2-methoxyethyl)-2-(4-methoxyphenyl)-1-methyl-6-oxopiperidine-3-carboxamide
SB13-0079 Screening compound: N-(2-methoxyethyl)-2-(4-methoxyphenyl)-1-methyl-6-oxopiperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SB13-0079
N-(2-methoxyethyl)-2-(4-methoxyphenyl)-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

SB13-0079

Molecular Formula

C17H24N2O4 (C17 H24 N2 O4)

Compound Name

N-(2-methoxyethyl)-2-(4-methoxyphenyl)-1-methyl-6-oxopiperidine-3-carboxamide

IUPAC name

(2R3R)-N-(2-methoxyethyl)-2-(4-methoxyphenyl)-1-methyl-6-oxopiperidine-3-carboxamide

SMILES

CN([C@@H]([C@H](CC1)C(NCCOC)=O)c(cc2)ccc2OC)C1=O

InChI

InChI=1S/C17H24N2O4/c1-19-15(20)9-8-14(17(21)18-10-11-22-2)16(19)12-4-6-13(23-3)7-5-12/h4-7,14,16H,8-11H2,1-3H3,(H,18,21)/t14-,16-/m1/s1

InChI Key

SDLSAVCVENAYHG-GDBMZVCRSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.39

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

0.804

Distribution Coefficient, logD

0.804

Water Solubility, LogSw

-2.30

Polar Surface Area

56.650

Acid Dissociation Constant (pKa)

13.33

Base Dissociation Constant (pKb)

-1.34

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.94

SB13-0079 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with SB13-0079 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB13-0079?
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What is the minimum amount of SB13-0079 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB13-0079
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB13-0079
  • 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 SB13-0079 available by request