Y031-3213 Screening compound: N-[4-(propylsulfamoyl)phenyl]-2-(thiophen-2-yl)acetamide

Y031-3213 Screening compound: N-[4-(propylsulfamoyl)phenyl]-2-(thiophen-2-yl)acetamide
Y031-3213 Screening compound: N-[4-(propylsulfamoyl)phenyl]-2-(thiophen-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-3213
N-[4-(propylsulfamoyl)phenyl]-2-(thiophen-2-yl)acetamide

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

Y031-3213

Molecular Formula

C15H18N2O3S2 (C15 H18 N2 O3 S2)

Compound Name

N-[4-(propylsulfamoyl)phenyl]-2-(thiophen-2-yl)acetamide

IUPAC name

N-[4-(propylsulfamoyl)phenyl]-2-(thiophen-2-yl)acetamide

SMILES

CCCNS(c(cc1)ccc1NC(Cc1cccs1)=O)(=O)=O

InChI

InChI=1S/C15H18N2O3S2/c1-2-9-16-22(19,20)14-7-5-12(6-8-14)17-15(18)11-13-4-3-10-21-13/h3-8,10,16H,2,9,11H2,1H3,(H,17,18)

InChI Key

XBUNGFQXMKMPCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05741346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.595

Distribution Coefficient, logD

2.594

Water Solubility, LogSw

-3.14

Polar Surface Area

66.006

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

-1.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

Y031-3213 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Structure:
  • Pool

References: we are preparing a list of scientific research reports with Y031-3213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-3213?
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What is the minimum amount of Y031-3213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-3213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-3213
  • 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 Y031-3213 available by request