4100-2543 Screening compound: methyl 1-(4-chlorobenzenesulfonyl)piperidine-4-carboxylate

4100-2543 Screening compound: methyl 1-(4-chlorobenzenesulfonyl)piperidine-4-carboxylate
4100-2543 Screening compound: methyl 1-(4-chlorobenzenesulfonyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4100-2543
methyl 1-(4-chlorobenzenesulfonyl)piperidine-4-carboxylate

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

4100-2543

Molecular Formula

C13H16ClNO4S (C13 H16 ClNO4 S)

Compound Name

methyl 1-(4-chlorobenzenesulfonyl)piperidine-4-carboxylate

IUPAC name

methyl 1-(4-chlorobenzenesulfonyl)piperidine-4-carboxylate

SMILES

COC(C(CC1)CCN1S(c(cc1)ccc1Cl)(=O)=O)=O

InChI

InChI=1S/C13H16ClNO4S/c1-19-13(16)10-6-8-15(9-7-10)20(17,18)12-4-2-11(14)3-5-12/h2-5,10H,6-9H2,1H3

InChI Key

MIFDXCORWWJRKF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01045654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.79

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.369

Distribution Coefficient, logD

2.369

Water Solubility, LogSw

-2.88

Polar Surface Area

53.123

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

-4.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

4100-2543 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4100-2543 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4100-2543?
Check Price and Availability of 4100-2543, 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 4100-2543 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4100-2543
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4100-2543
  • 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 4100-2543 available by request