Y030-5839 Screening compound: N,N-diethyl-4-methoxy-3-(phenylmethanesulfonamido)benzene-1-sulfonamide

Y030-5839 Screening compound: N,N-diethyl-4-methoxy-3-(phenylmethanesulfonamido)benzene-1-sulfonamide
Y030-5839 Screening compound: N,N-diethyl-4-methoxy-3-(phenylmethanesulfonamido)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-5839
N,N-diethyl-4-methoxy-3-(phenylmethanesulfonamido)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

Y030-5839

Molecular Formula

C18H24N2O5S2 (C18 H24 N2 O5 S2)

Compound Name

N,N-diethyl-4-methoxy-3-(phenylmethanesulfonamido)benzene-1-sulfonamide

IUPAC name

NN-diethyl-4-methoxy-3-(phenylmethanesulfonamido)benzene-1-sulfonamide

SMILES

CCN(CC)S(c(cc1)cc(NS(Cc2ccccc2)(=O)=O)c1OC)(=O)=O

InChI

InChI=1S/C18H24N2O5S2/c1-4-20(5-2)27(23,24)16-11-12-18(25-3)17(13-16)19-26(21,22)14-15-9-7-6-8-10-15/h6-13,19H,4-5,14H2,1-3H3

InChI Key

LYBYEIVEMDNVJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03575443

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.53

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.688

Distribution Coefficient, logD

0.688

Water Solubility, LogSw

-3.12

Polar Surface Area

80.544

Acid Dissociation Constant (pKa)

5.40

Base Dissociation Constant (pKb)

-3.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

Y030-5839 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Protein Arginine Methyltransferases Library (27925 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:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with Y030-5839 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-5839?
Check Price and Availability of Y030-5839, 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 Y030-5839 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-5839
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-5839
  • 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 Y030-5839 available by request