E786-0733 Screening compound: ethyl 4-[4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamido]benzoate

E786-0733 Screening compound: ethyl 4-[4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamido]benzoate
E786-0733 Screening compound: ethyl 4-[4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound E786-0733
ethyl 4-[4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamido]benzoate

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

E786-0733

Molecular Formula

C19H18N2O5S (C19 H18 N2 O5 S)

Compound Name

ethyl 4-[4-(3-methyl-1,2-oxazol-5-yl)benzenesulfonamido]benzoate

IUPAC name

ethyl 4-[4-(3-methyl-12-oxazol-5-yl)benzenesulfonamido]benzoate

SMILES

CCOC(c(cc1)ccc1NS(c(cc1)ccc1-c1cc(C)no1)(=O)=O)=O

InChI

InChI=1S/C19H18N2O5S/c1-3-25-19(22)15-4-8-16(9-5-15)21-27(23,24)17-10-6-14(7-11-17)18-12-13(2)20-26-18/h4-12,21H,3H2,1-2H3

InChI Key

SGZQSFYPASEIIU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14918700

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.084

Distribution Coefficient, logD

3.621

Water Solubility, LogSw

-4.09

Polar Surface Area

82.983

Acid Dissociation Constant (pKa)

7.12

Base Dissociation Constant (pKb)

-2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

E786-0733 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

SH2 Library (10483 compounds)

Serine Proteases Inhibitors Library (32732 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
Therapeutical areas:
  • Cancer
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with E786-0733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E786-0733?
Check Price and Availability of E786-0733, 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 E786-0733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E786-0733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E786-0733
  • 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 E786-0733 available by request