Y040-4524 Screening compound: 1-(4-methoxybenzenesulfonyl)-4-phenylpiperidine-4-carboxylic acid

Y040-4524 Screening compound: 1-(4-methoxybenzenesulfonyl)-4-phenylpiperidine-4-carboxylic acid
Y040-4524 Screening compound: 1-(4-methoxybenzenesulfonyl)-4-phenylpiperidine-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y040-4524
1-(4-methoxybenzenesulfonyl)-4-phenylpiperidine-4-carboxylic acid

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

Y040-4524

Molecular Formula

C19H21NO5S (C19 H21 NO5 S)

Compound Name

1-(4-methoxybenzenesulfonyl)-4-phenylpiperidine-4-carboxylic acid

IUPAC name

1-(4-methoxybenzenesulfonyl)-4-phenylpiperidine-4-carboxylic acid

SMILES

COc(cc1)ccc1S(N(CC1)CCC1(C(O)=O)c1ccccc1)(=O)=O

InChI

InChI=1S/C19H21NO5S/c1-25-16-7-9-17(10-8-16)26(23,24)20-13-11-19(12-14-20,18(21)22)15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,21,22)

InChI Key

OTOVPVWUAPUWOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05997247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.45

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.710

Distribution Coefficient, logD

0.162

Water Solubility, LogSw

-2.94

Polar Surface Area

67.630

Acid Dissociation Constant (pKa)

4.85

Base Dissociation Constant (pKb)

-4.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

Y040-4524 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Dark Chemical Matter Library (18430 compounds)

Immunological Library (6760 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
  • Immune system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y040-4524 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y040-4524?
Check Price and Availability of Y040-4524, 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 Y040-4524 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y040-4524
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y040-4524
  • 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 Y040-4524 available by request