C517-4062 Screening compound: 2-[N-(4-methoxyphenyl)3,5-dimethyl-1,2-oxazole-4-sulfonamido]-N-[2-(3-methylphenyl)ethyl]acetamide

C517-4062 Screening compound: 2-[N-(4-methoxyphenyl)3,5-dimethyl-1,2-oxazole-4-sulfonamido]-N-[2-(3-methylphenyl)ethyl]acetamide
C517-4062 Screening compound: 2-[N-(4-methoxyphenyl)3,5-dimethyl-1,2-oxazole-4-sulfonamido]-N-[2-(3-methylphenyl)ethyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C517-4062
2-[N-(4-methoxyphenyl)3,5-dimethyl-1,2-oxazole-4-sulfonamido]-N-[2-(3-methylphenyl)ethyl]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

C517-4062

Molecular Formula

C23H27N3O5S (C23 H27 N3 O5 S)

Compound Name

2-[N-(4-methoxyphenyl)3,5-dimethyl-1,2-oxazole-4-sulfonamido]-N-[2-(3-methylphenyl)ethyl]acetamide

IUPAC name

2-[N-(4-methoxyphenyl)35-dimethyl-12-oxazole-4-sulfonamido]-N-[2-(3-methylphenyl)ethyl]acetamide

SMILES

Cc1noc(C)c1S(N(CC(NCCc1cc(C)ccc1)=O)c(cc1)ccc1OC)(=O)=O

InChI

InChI=1S/C23H27N3O5S/c1-16-6-5-7-19(14-16)12-13-24-22(27)15-26(20-8-10-21(30-4)11-9-20)32(28,29)23-17(2)25-31-18(23)3/h5-11,14H,12-13,15H2,1-4H3,(H,24,27)

InChI Key

KBNSWEUJYCJTAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14763973

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.744

Distribution Coefficient, logD

2.744

Water Solubility, LogSw

-3.35

Polar Surface Area

85.687

Acid Dissociation Constant (pKa)

14.59

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

C517-4062 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral Annotated Library (21441 compounds)

CNS Annotated Library (688 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with C517-4062 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C517-4062?
Check Price and Availability of C517-4062, 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 C517-4062 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C517-4062
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C517-4062
  • 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 C517-4062 available by request