4388-0112 Screening compound: 4-methoxy-N-(4-methylbenzenesulfonyl)-N-(4-methylphenyl)benzamide

4388-0112 Screening compound: 4-methoxy-N-(4-methylbenzenesulfonyl)-N-(4-methylphenyl)benzamide
4388-0112 Screening compound: 4-methoxy-N-(4-methylbenzenesulfonyl)-N-(4-methylphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4388-0112
4-methoxy-N-(4-methylbenzenesulfonyl)-N-(4-methylphenyl)benzamide

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

4388-0112

Molecular Formula

C22H21NO4S (C22 H21 NO4 S)

Compound Name

4-methoxy-N-(4-methylbenzenesulfonyl)-N-(4-methylphenyl)benzamide

IUPAC name

4-methoxy-N-(4-methylbenzenesulfonyl)-N-(4-methylphenyl)benzamide

SMILES

Cc(cc1)ccc1N(C(c(cc1)ccc1OC)=O)S(c1ccc(C)cc1)(=O)=O

InChI

InChI=1S/C22H21NO4S/c1-16-4-10-19(11-5-16)23(22(24)18-8-12-20(27-3)13-9-18)28(25,26)21-14-6-17(2)7-15-21/h4-15H,1-3H3

InChI Key

ADHDPLULDYOLCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03447454

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.794

Distribution Coefficient, logD

4.794

Water Solubility, LogSw

-4.63

Polar Surface Area

53.090

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-14.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

4388-0112 in Drug Discovery

Included in Screening Libraries

Human GPCR Annotated Library (5539 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 4388-0112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4388-0112?
Check Price and Availability of 4388-0112, 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 4388-0112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4388-0112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4388-0112
  • 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 4388-0112 available by request