8019-3893 Screening compound: 2-[(4-methylphenyl)methanesulfonyl]-N-phenylacetamide

8019-3893 Screening compound: 2-[(4-methylphenyl)methanesulfonyl]-N-phenylacetamide
8019-3893 Screening compound: 2-[(4-methylphenyl)methanesulfonyl]-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-3893
2-[(4-methylphenyl)methanesulfonyl]-N-phenylacetamide

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

8019-3893

Molecular Formula

C16H17NO3S (C16 H17 NO3 S)

Compound Name

2-[(4-methylphenyl)methanesulfonyl]-N-phenylacetamide

IUPAC name

2-[(4-methylphenyl)methanesulfonyl]-N-phenylacetamide

SMILES

Cc1ccc(CS(CC(Nc2ccccc2)=O)(=O)=O)cc1

InChI

InChI=1S/C16H17NO3S/c1-13-7-9-14(10-8-13)11-21(19,20)12-16(18)17-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,17,18)

InChI Key

NWTSTPZQKALREV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07748142

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

303.38

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.137

Distribution Coefficient, logD

2.137

Water Solubility, LogSw

-2.67

Polar Surface Area

51.416

Acid Dissociation Constant (pKa)

11.34

Base Dissociation Constant (pKb)

-1.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8019-3893 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 8019-3893 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-3893?
Check Price and Availability of 8019-3893, 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 8019-3893 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-3893
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-3893
  • 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 8019-3893 available by request