Y050-1138 Screening compound: 4-ethoxy-3-methyl-N-[3-(methylsulfanyl)phenyl]benzene-1-sulfonamide

Y050-1138 Screening compound: 4-ethoxy-3-methyl-N-[3-(methylsulfanyl)phenyl]benzene-1-sulfonamide
Y050-1138 Screening compound: 4-ethoxy-3-methyl-N-[3-(methylsulfanyl)phenyl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y050-1138
4-ethoxy-3-methyl-N-[3-(methylsulfanyl)phenyl]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

Y050-1138

Molecular Formula

C16H19NO3S2 (C16 H19 NO3 S2)

Compound Name

4-ethoxy-3-methyl-N-[3-(methylsulfanyl)phenyl]benzene-1-sulfonamide

IUPAC name

4-ethoxy-3-methyl-N-[3-(methylsulfanyl)phenyl]benzene-1-sulfonamide

SMILES

CCOc(cc1)c(C)cc1S(Nc1cc(SC)ccc1)(=O)=O

InChI

InChI=1S/C16H19NO3S2/c1-4-20-16-9-8-15(10-12(16)2)22(18,19)17-13-6-5-7-14(11-13)21-3/h5-11,17H,4H2,1-3H3

InChI Key

LXPUDUHHBLJWGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07361175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.195

Distribution Coefficient, logD

4.193

Water Solubility, LogSw

-4.37

Polar Surface Area

48.098

Acid Dissociation Constant (pKa)

9.63

Base Dissociation Constant (pKb)

-10.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

Y050-1138 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
  • Cancer
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y050-1138 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y050-1138?
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What is the minimum amount of Y050-1138 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y050-1138
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y050-1138
  • 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 Y050-1138 available by request