Y050-1535 Screening compound: 1-(4-ETHOXYBENZENESULFONYL)-3-(PYRROLIDINE-1-CARBONYL)PIPERIDINE

Y050-1535 Screening compound: 1-(4-ETHOXYBENZENESULFONYL)-3-(PYRROLIDINE-1-CARBONYL)PIPERIDINE
Y050-1535 Screening compound: 1-(4-ETHOXYBENZENESULFONYL)-3-(PYRROLIDINE-1-CARBONYL)PIPERIDINE alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-1535
1-(4-ETHOXYBENZENESULFONYL)-3-(PYRROLIDINE-1-CARBONYL)PIPERIDINE

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

Y050-1535

Molecular Formula

C18H26N2O4S (C18 H26 N2 O4 S)

Compound Name

1-(4-ETHOXYBENZENESULFONYL)-3-(PYRROLIDINE-1-CARBONYL)PIPERIDINE

IUPAC name

1-(4-ethoxybenzenesulfonyl)-3-(pyrrolidine-1-carbonyl)piperidine

SMILES

CCOc(cc1)ccc1S(N(CCC1)CC1C(N1CCCC1)=O)(=O)=O

InChI

InChI=1S/C18H26N2O4S/c1-2-24-16-7-9-17(10-8-16)25(22,23)20-13-5-6-15(14-20)18(21)19-11-3-4-12-19/h7-10,15H,2-6,11-14H2,1H3/t15-/m0/s1

InChI Key

WQPCKCRNODNVJR-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD08069552

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.48

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.364

Distribution Coefficient, logD

2.364

Water Solubility, LogSw

-2.57

Polar Surface Area

56.021

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

-2.36

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

61.10

Y050-1535 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Inflammatory Library (24602 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with Y050-1535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-1535?
Check Price and Availability of Y050-1535, 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 Y050-1535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-1535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-1535
  • 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 Y050-1535 available by request