M857-0183 Screening compound: 1-({1-[(2,5-dimethylbenzyl)sulfonyl]-4-piperidyl}methyl)-3-methylpiperidine

M857-0183 Screening compound: 1-({1-[(2,5-dimethylbenzyl)sulfonyl]-4-piperidyl}methyl)-3-methylpiperidine
M857-0183 Screening compound: 1-({1-[(2,5-dimethylbenzyl)sulfonyl]-4-piperidyl}methyl)-3-methylpiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound M857-0183
1-({1-[(2,5-dimethylbenzyl)sulfonyl]-4-piperidyl}methyl)-3-methylpiperidine

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

M857-0183

Molecular Formula

C21H34N2O2S (C21 H34 N2 O2 S)

Compound Name

1-({1-[(2,5-dimethylbenzyl)sulfonyl]-4-piperidyl}methyl)-3-methylpiperidine

IUPAC name

1-[(25-dimethylphenyl)methanesulfonyl]-4-[(3-methylpiperidin-1-yl)methyl]piperidine

SMILES

CC1CN(CC(CC2)CCN2S(Cc2c(C)ccc(C)c2)(=O)=O)CCC1

InChI

InChI=1S/C21H34N2O2S/c1-17-6-7-19(3)21(13-17)16-26(24,25)23-11-8-20(9-12-23)15-22-10-4-5-18(2)14-22/h6-7,13,18,20H,4-5,8-12,14-16H2,1-3H3/t18-/m0/s1

InChI Key

DVOGGIRVZPQFJC-SFHVURJKSA-N

MDL Number (MFCD)

MFCD27555556

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.345

Distribution Coefficient, logD

1.431

Water Solubility, LogSw

-4.18

Polar Surface Area

35.510

Acid Dissociation Constant (pKa)

20.24

Base Dissociation Constant (pKb)

10.31

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

71.43

M857-0183 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with M857-0183 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M857-0183?
Check Price and Availability of M857-0183, 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 M857-0183 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M857-0183
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M857-0183
  • 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 M857-0183 available by request