D356-0363 Screening compound: N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)-1-phenylmethanesulfonylpiperidine-4-carboxamide

D356-0363 Screening compound: N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)-1-phenylmethanesulfonylpiperidine-4-carboxamide
D356-0363 Screening compound: N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)-1-phenylmethanesulfonylpiperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-0363
N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)-1-phenylmethanesulfonylpiperidine-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

D356-0363

Molecular Formula

C23H30N2O3S2 (C23 H30 N2 O3 S2)

Compound Name

N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)-1-phenylmethanesulfonylpiperidine-4-carboxamide

IUPAC name

N-(2-{[(2-methylphenyl)methyl]sulfanyl}ethyl)-1-phenylmethanesulfonylpiperidine-4-carboxamide

SMILES

Cc1c(CSCCNC(C(CC2)CCN2S(Cc2ccccc2)(=O)=O)=O)cccc1

InChI

InChI=1S/C23H30N2O3S2/c1-19-7-5-6-10-22(19)17-29-16-13-24-23(26)21-11-14-25(15-12-21)30(27,28)18-20-8-3-2-4-9-20/h2-10,21H,11-18H2,1H3,(H,24,26)

InChI Key

WTXQBPDLQVWOSH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14822569

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.63

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.691

Distribution Coefficient, logD

3.691

Water Solubility, LogSw

-3.70

Polar Surface Area

56.098

Acid Dissociation Constant (pKa)

14.01

Base Dissociation Constant (pKb)

0.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

D356-0363 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D356-0363 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-0363?
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What is the minimum amount of D356-0363 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-0363
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-0363
  • 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 D356-0363 available by request