D356-0547 Screening compound: N-[(2-methoxyphenyl)methyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

D356-0547 Screening compound: N-[(2-methoxyphenyl)methyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
D356-0547 Screening compound: N-[(2-methoxyphenyl)methyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-0547
N-[(2-methoxyphenyl)methyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-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

D356-0547

Molecular Formula

C22H28N2O4S (C22 H28 N2 O4 S)

Compound Name

N-[(2-methoxyphenyl)methyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

IUPAC name

N-[(2-methoxyphenyl)methyl]-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

SMILES

Cc1c(CS(N(CC2)CCC2C(NCc(cccc2)c2OC)=O)(=O)=O)cccc1

InChI

InChI=1S/C22H28N2O4S/c1-17-7-3-4-9-20(17)16-29(26,27)24-13-11-18(12-14-24)22(25)23-15-19-8-5-6-10-21(19)28-2/h3-10,18H,11-16H2,1-2H3,(H,23,25)

InChI Key

PQQSFUFGBBQZDV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14822718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.255

Distribution Coefficient, logD

3.255

Water Solubility, LogSw

-3.37

Polar Surface Area

63.887

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

-1.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

D356-0547 in Drug Discovery

Included in Screening Libraries

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with D356-0547 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-0547?
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What is the minimum amount of D356-0547 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-0547
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-0547
  • 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 D356-0547 available by request