Y050-0727 Screening compound: 2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]-N-phenylacetamide

Y050-0727 Screening compound: 2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]-N-phenylacetamide
Y050-0727 Screening compound: 2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-0727
2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]-N-phenylacetamide

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

Y050-0727

Molecular Formula

C19H22N2O4S (C19 H22 N2 O4 S)

Compound Name

2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]-N-phenylacetamide

IUPAC name

2-[2-methyl-4-(pyrrolidine-1-sulfonyl)phenoxy]-N-phenylacetamide

SMILES

Cc(cc(cc1)S(N2CCCC2)(=O)=O)c1OCC(Nc1ccccc1)=O

InChI

InChI=1S/C19H22N2O4S/c1-15-13-17(26(23,24)21-11-5-6-12-21)9-10-18(15)25-14-19(22)20-16-7-3-2-4-8-16/h2-4,7-10,13H,5-6,11-12,14H2,1H3,(H,20,22)

InChI Key

LPMGTAALQLGIHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06625261

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.309

Distribution Coefficient, logD

3.309

Water Solubility, LogSw

-3.67

Polar Surface Area

62.779

Acid Dissociation Constant (pKa)

12.67

Base Dissociation Constant (pKb)

-0.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

Y050-0727 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 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

References: we are preparing a list of scientific research reports with Y050-0727 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-0727?
Check Price and Availability of Y050-0727, 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 Y050-0727 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-0727
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-0727
  • 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 Y050-0727 available by request