Y050-0493 Screening compound: 4-{2-[4-(cyclohexylsulfamoyl)-2-methylphenoxy]acetamido}benzamide

Y050-0493 Screening compound: 4-{2-[4-(cyclohexylsulfamoyl)-2-methylphenoxy]acetamido}benzamide
Y050-0493 Screening compound: 4-{2-[4-(cyclohexylsulfamoyl)-2-methylphenoxy]acetamido}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-0493
4-{2-[4-(cyclohexylsulfamoyl)-2-methylphenoxy]acetamido}benzamide

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

Y050-0493

Molecular Formula

C22H27N3O5S (C22 H27 N3 O5 S)

Compound Name

4-{2-[4-(cyclohexylsulfamoyl)-2-methylphenoxy]acetamido}benzamide

IUPAC name

4-{2-[4-(cyclohexylsulfamoyl)-2-methylphenoxy]acetamido}benzamide

SMILES

Cc(cc(cc1)S(NC2CCCCC2)(=O)=O)c1OCC(Nc(cc1)ccc1C(N)=O)=O

InChI

InChI=1S/C22H27N3O5S/c1-15-13-19(31(28,29)25-18-5-3-2-4-6-18)11-12-20(15)30-14-21(26)24-17-9-7-16(8-10-17)22(23)27/h7-13,18,25H,2-6,14H2,1H3,(H2,23,27)(H,24,26)

InChI Key

COBDRXWZADHTIZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06003660

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

445.54

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.378

Distribution Coefficient, logD

3.378

Water Solubility, LogSw

-3.79

Polar Surface Area

106.458

Acid Dissociation Constant (pKa)

10.47

Base Dissociation Constant (pKb)

-1.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

Y050-0493 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with Y050-0493 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-0493?
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What is the minimum amount of Y050-0493 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-0493
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-0493
  • 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 Y050-0493 available by request