Y030-6906 Screening compound: N-tert-butyl-4-(4-methylbenzenesulfonamido)benzene-1-sulfonamide

Y030-6906 Screening compound: N-tert-butyl-4-(4-methylbenzenesulfonamido)benzene-1-sulfonamide
Y030-6906 Screening compound: N-tert-butyl-4-(4-methylbenzenesulfonamido)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y030-6906
N-tert-butyl-4-(4-methylbenzenesulfonamido)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

Y030-6906

Molecular Formula

C17H22N2O4S2 (C17 H22 N2 O4 S2)

Compound Name

N-tert-butyl-4-(4-methylbenzenesulfonamido)benzene-1-sulfonamide

IUPAC name

N-tert-butyl-4-(4-methylbenzenesulfonamido)benzene-1-sulfonamide

SMILES

CC(C)(C)NS(c(cc1)ccc1NS(c1ccc(C)cc1)(=O)=O)(=O)=O

InChI

InChI=1S/C17H22N2O4S2/c1-13-5-9-15(10-6-13)24(20,21)18-14-7-11-16(12-8-14)25(22,23)19-17(2,3)4/h5-12,18-19H,1-4H3

InChI Key

UZVMRUKQFMWJNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03351676

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.5

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.378

Distribution Coefficient, logD

2.308

Water Solubility, LogSw

-3.61

Polar Surface Area

81.955

Acid Dissociation Constant (pKa)

6.37

Base Dissociation Constant (pKb)

-4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

Y030-6906 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

3D-Biodiversity Library (27607 compounds)

CORONAVIRUS Library (20774 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Structure:
  • 3D
Agro:
  • Agro

References: we are preparing a list of scientific research reports with Y030-6906 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y030-6906?
Check Price and Availability of Y030-6906, 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 Y030-6906 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y030-6906
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y030-6906
  • 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 Y030-6906 available by request