Y050-2287 Screening compound: N-(4-methoxyphenyl)-3-methyl-4-[2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethoxy]benzene-1-sulfonamide

Y050-2287 Screening compound: N-(4-methoxyphenyl)-3-methyl-4-[2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethoxy]benzene-1-sulfonamide
Y050-2287 Screening compound: N-(4-methoxyphenyl)-3-methyl-4-[2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethoxy]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-2287
N-(4-methoxyphenyl)-3-methyl-4-[2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethoxy]benzene-1-sulfonamide

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

Y050-2287

Molecular Formula

C25H26N2O5S (C25 H26 N2 O5 S)

Compound Name

N-(4-methoxyphenyl)-3-methyl-4-[2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethoxy]benzene-1-sulfonamide

IUPAC name

N-(4-methoxyphenyl)-3-methyl-4-[2-oxo-2-(1234-tetrahydroisoquinolin-2-yl)ethoxy]benzene-1-sulfonamide

SMILES

Cc(cc(cc1)S(Nc(cc2)ccc2OC)(=O)=O)c1OCC(N(CC1)Cc2c1cccc2)=O

InChI

InChI=1S/C25H26N2O5S/c1-18-15-23(33(29,30)26-21-7-9-22(31-2)10-8-21)11-12-24(18)32-17-25(28)27-14-13-19-5-3-4-6-20(19)16-27/h3-12,15,26H,13-14,16-17H2,1-2H3

InChI Key

NVWYNPNYUKRYTB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08684826

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

466.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.182

Distribution Coefficient, logD

4.178

Water Solubility, LogSw

-4.32

Polar Surface Area

71.800

Acid Dissociation Constant (pKa)

9.49

Base Dissociation Constant (pKb)

-2.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

Y050-2287 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with Y050-2287 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-2287?
Check Price and Availability of Y050-2287, 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 Y050-2287 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-2287
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-2287
  • 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 Y050-2287 available by request