4853-0019 Screening compound: 2,3-dimethyl-5-phenyl-1,2-oxazol-2-ium

4853-0019 Screening compound: 2,3-dimethyl-5-phenyl-1,2-oxazol-2-ium
4853-0019 Screening compound: 2,3-dimethyl-5-phenyl-1,2-oxazol-2-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 4853-0019
2,3-dimethyl-5-phenyl-1,2-oxazol-2-ium

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

4853-0019

Molecular Formula

C11H12NO (C11 H12 NO)

Compound Name

2,3-dimethyl-5-phenyl-1,2-oxazol-2-ium

IUPAC name

23-dimethyl-5-phenyl-12-oxazol-2-ium

SMILES

Cc1[n+](C)oc(-c2ccccc2)c1

InChI

InChI=1S/C11H12NO/c1-9-8-11(13-12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3/q+1

InChI Key

LSURHETZDRYFCF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03827036

Chemical and Physical Properties

Saltdata

I-

Molecular Weight

174.22

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.334

Distribution Coefficient, logD

2.334

Water Solubility, LogSw

-2.33

Polar Surface Area

12.626

Acid Dissociation Constant (pKa)

31.75

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

4853-0019 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Akt-Targeted Library (14764 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 4853-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4853-0019?
Check Price and Availability of 4853-0019, 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 4853-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4853-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4853-0019
  • 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 4853-0019 available by request