D356-0865 Screening compound: methyl 2-chloro-5-{1-[(3-methylphenyl)methanesulfonyl]piperidine-4-amido}benzoate

D356-0865 Screening compound: methyl 2-chloro-5-{1-[(3-methylphenyl)methanesulfonyl]piperidine-4-amido}benzoate
D356-0865 Screening compound: methyl 2-chloro-5-{1-[(3-methylphenyl)methanesulfonyl]piperidine-4-amido}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D356-0865
methyl 2-chloro-5-{1-[(3-methylphenyl)methanesulfonyl]piperidine-4-amido}benzoate

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

D356-0865

Molecular Formula

C22H25ClN2O5S (C22 H25 ClN2 O5 S)

Compound Name

methyl 2-chloro-5-{1-[(3-methylphenyl)methanesulfonyl]piperidine-4-amido}benzoate

IUPAC name

methyl 2-chloro-5-{1-[(3-methylphenyl)methanesulfonyl]piperidine-4-amido}benzoate

SMILES

Cc1cccc(CS(N(CC2)CCC2C(Nc(cc2)cc(C(OC)=O)c2Cl)=O)(=O)=O)c1

InChI

InChI=1S/C22H25ClN2O5S/c1-15-4-3-5-16(12-15)14-31(28,29)25-10-8-17(9-11-25)21(26)24-18-6-7-20(23)19(13-18)22(27)30-2/h3-7,12-13,17H,8-11,14H2,1-2H3,(H,24,26)

InChI Key

DRBSLZDJLAZICV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14822992

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.97

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.959

Distribution Coefficient, logD

3.957

Water Solubility, LogSw

-4.31

Polar Surface Area

76.109

Acid Dissociation Constant (pKa)

9.71

Base Dissociation Constant (pKb)

-2.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

D356-0865 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with D356-0865 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D356-0865?
Check Price and Availability of D356-0865, 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 D356-0865 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D356-0865
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D356-0865
  • 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 D356-0865 available by request