6494-0071 Screening compound: 3-[(2-methoxyphenyl)methyl]-5-methyl-2,3-dihydro-1,3-benzoxazol-2-one

6494-0071 Screening compound: 3-[(2-methoxyphenyl)methyl]-5-methyl-2,3-dihydro-1,3-benzoxazol-2-one
6494-0071 Screening compound: 3-[(2-methoxyphenyl)methyl]-5-methyl-2,3-dihydro-1,3-benzoxazol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6494-0071
3-[(2-methoxyphenyl)methyl]-5-methyl-2,3-dihydro-1,3-benzoxazol-2-one

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

6494-0071

Molecular Formula

C16H15NO3 (C16 H15 NO3)

Compound Name

3-[(2-methoxyphenyl)methyl]-5-methyl-2,3-dihydro-1,3-benzoxazol-2-one

IUPAC name

3-[(2-methoxyphenyl)methyl]-5-methyl-23-dihydro-13-benzoxazol-2-one

SMILES

Cc(cc1)cc(N2Cc(cccc3)c3OC)c1OC2=O

InChI

InChI=1S/C16H15NO3/c1-11-7-8-15-13(9-11)17(16(18)20-15)10-12-5-3-4-6-14(12)19-2/h3-9H,10H2,1-2H3

InChI Key

GIEWDXYFECFVMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04092167

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

269.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.610

Distribution Coefficient, logD

3.610

Water Solubility, LogSw

-3.77

Polar Surface Area

30.697

Acid Dissociation Constant (pKa)

26.39

Base Dissociation Constant (pKb)

-3.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

6494-0071 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic
Agro:
  • Agro
Targets:
  • Others

References: we are preparing a list of scientific research reports with 6494-0071 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6494-0071?
Check Price and Availability of 6494-0071, 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 6494-0071 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6494-0071
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6494-0071
  • 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 6494-0071 available by request