SA59-0497 Screening compound: 2-(3,5-dimethoxyphenyl)-N-(oxan-4-yl)-N-[2-(piperidin-1-yl)ethyl]acetamide

SA59-0497 Screening compound: 2-(3,5-dimethoxyphenyl)-N-(oxan-4-yl)-N-[2-(piperidin-1-yl)ethyl]acetamide
SA59-0497 Screening compound: 2-(3,5-dimethoxyphenyl)-N-(oxan-4-yl)-N-[2-(piperidin-1-yl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound SA59-0497
2-(3,5-dimethoxyphenyl)-N-(oxan-4-yl)-N-[2-(piperidin-1-yl)ethyl]acetamide

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

SA59-0497

Molecular Formula

C22H34N2O4 (C22 H34 N2 O4)

Compound Name

2-(3,5-dimethoxyphenyl)-N-(oxan-4-yl)-N-[2-(piperidin-1-yl)ethyl]acetamide

IUPAC name

2-(35-dimethoxyphenyl)-N-(oxan-4-yl)-N-[2-(piperidin-1-yl)ethyl]acetamide

SMILES

COc1cc(CC(N(CCN2CCCCC2)C2CCOCC2)=O)cc(OC)c1

InChI

InChI=1S/C22H34N2O4/c1-26-20-14-18(15-21(17-20)27-2)16-22(25)24(19-6-12-28-13-7-19)11-10-23-8-4-3-5-9-23/h14-15,17,19H,3-13,16H2,1-2H3

InChI Key

OBIVZPAWIGRZDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32001123

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.710

Distribution Coefficient, logD

1.045

Water Solubility, LogSw

-2.81

Polar Surface Area

41.852

Acid Dissociation Constant (pKa)

18.79

Base Dissociation Constant (pKb)

9.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.18

SA59-0497 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with SA59-0497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA59-0497?
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What is the minimum amount of SA59-0497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA59-0497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA59-0497
  • 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 SA59-0497 available by request