4790-1199 Screening compound: 2-(4-methoxyphenyl)-4H-3,1-benzoxazin-4-one

4790-1199 Screening compound: 2-(4-methoxyphenyl)-4H-3,1-benzoxazin-4-one
4790-1199 Screening compound: 2-(4-methoxyphenyl)-4H-3,1-benzoxazin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4790-1199
2-(4-methoxyphenyl)-4H-3,1-benzoxazin-4-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

4790-1199

Molecular Formula

C15H11NO3 (C15 H11 NO3)

Compound Name

2-(4-methoxyphenyl)-4H-3,1-benzoxazin-4-one

IUPAC name

2-(4-methoxyphenyl)-4H-31-benzoxazin-4-one

SMILES

COc(cc1)ccc1C(O1)=Nc(cccc2)c2C1=O

InChI

InChI=1S/C15H11NO3/c1-18-11-8-6-10(7-9-11)14-16-13-5-3-2-4-12(13)15(17)19-14/h2-9H,1H3

InChI Key

DOBFHWQIDTXPFM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00729216

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

253.26

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.669

Distribution Coefficient, logD

2.669

Water Solubility, LogSw

-3.61

Polar Surface Area

37.729

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

4790-1199 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Cardiovascular Library (22201 compounds)

GABA Library (7115 compounds)

STING Agonist Library (5895 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cardiovascular
  • Eye
  • Cancer
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR
  • Ion Channels
  • Others
  • Proteases

References: we are preparing a list of scientific research reports with 4790-1199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4790-1199?
Check Price and Availability of 4790-1199, 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 4790-1199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4790-1199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4790-1199
  • 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 4790-1199 available by request