D356-0558 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

D356-0558 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide
D356-0558 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-0558
N-(2H-1,3-benzodioxol-5-yl)-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

D356-0558

Molecular Formula

C21H24N2O5S (C21 H24 N2 O5 S)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-1-[(2-methylphenyl)methanesulfonyl]piperidine-4-carboxamide

SMILES

Cc1c(CS(N(CC2)CCC2C(Nc(cc2)cc3c2OCO3)=O)(=O)=O)cccc1

InChI

InChI=1S/C21H24N2O5S/c1-15-4-2-3-5-17(15)13-29(25,26)23-10-8-16(9-11-23)21(24)22-18-6-7-19-20(12-18)28-14-27-19/h2-7,12,16H,8-11,13-14H2,1H3,(H,22,24)

InChI Key

GXCRSDOYQVKICU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14822728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

416.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.178

Distribution Coefficient, logD

3.178

Water Solubility, LogSw

-3.24

Polar Surface Area

72.050

Acid Dissociation Constant (pKa)

10.77

Base Dissociation Constant (pKb)

1.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with D356-0558 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-0558?
Check Price and Availability of D356-0558, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D356-0558 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-0558
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-0558
  • 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 D356-0558 available by request