6064-0085 Screening compound: N-[(4-methoxyphenyl)methyl]-2-{4-[(propan-2-yl)sulfamoyl]phenoxy}acetamide

6064-0085 Screening compound: N-[(4-methoxyphenyl)methyl]-2-{4-[(propan-2-yl)sulfamoyl]phenoxy}acetamide
6064-0085 Screening compound: N-[(4-methoxyphenyl)methyl]-2-{4-[(propan-2-yl)sulfamoyl]phenoxy}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6064-0085
N-[(4-methoxyphenyl)methyl]-2-{4-[(propan-2-yl)sulfamoyl]phenoxy}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

6064-0085

Molecular Formula

C19H24N2O5S (C19 H24 N2 O5 S)

Compound Name

N-[(4-methoxyphenyl)methyl]-2-{4-[(propan-2-yl)sulfamoyl]phenoxy}acetamide

IUPAC name

N-[(4-methoxyphenyl)methyl]-2-{4-[(propan-2-yl)sulfamoyl]phenoxy}acetamide

SMILES

CC(C)NS(c(cc1)ccc1OCC(NCc(cc1)ccc1OC)=O)(=O)=O

InChI

InChI=1S/C19H24N2O5S/c1-14(2)21-27(23,24)18-10-8-17(9-11-18)26-13-19(22)20-12-15-4-6-16(25-3)7-5-15/h4-11,14,21H,12-13H2,1-3H3,(H,20,22)

InChI Key

ALDZZVQWJFJKQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03862259

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.48

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.507

Distribution Coefficient, logD

2.506

Water Solubility, LogSw

-2.84

Polar Surface Area

80.699

Acid Dissociation Constant (pKa)

11.67

Base Dissociation Constant (pKb)

-2.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

6064-0085 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 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

References: we are preparing a list of scientific research reports with 6064-0085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6064-0085?
Check Price and Availability of 6064-0085, 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 6064-0085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6064-0085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6064-0085
  • 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 6064-0085 available by request