4783-0447 Screening compound: 2-(2-methoxyphenoxy)-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]acetamide

4783-0447 Screening compound: 2-(2-methoxyphenoxy)-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]acetamide
4783-0447 Screening compound: 2-(2-methoxyphenoxy)-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4783-0447
2-(2-methoxyphenoxy)-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]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

4783-0447

Molecular Formula

C23H18N2O5 (C23 H18 N2 O5)

Compound Name

2-(2-methoxyphenoxy)-N-[4-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]acetamide

IUPAC name

2-(2-methoxyphenoxy)-N-[4-(4-oxo-4H-31-benzoxazin-2-yl)phenyl]acetamide

SMILES

COc(cccc1)c1OCC(Nc(cc1)ccc1C(O1)=Nc(cccc2)c2C1=O)=O

InChI

InChI=1S/C23H18N2O5/c1-28-19-8-4-5-9-20(19)29-14-21(26)24-16-12-10-15(11-13-16)22-25-18-7-3-2-6-17(18)23(27)30-22/h2-13H,14H2,1H3,(H,24,26)

InChI Key

NFQCEEZZCWJFBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01974958

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.41

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.299

Distribution Coefficient, logD

3.299

Water Solubility, LogSw

-3.96

Polar Surface Area

68.280

Acid Dissociation Constant (pKa)

11.99

Base Dissociation Constant (pKb)

0.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.70

4783-0447 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 4783-0447 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4783-0447?
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What is the minimum amount of 4783-0447 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4783-0447
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4783-0447
  • 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 4783-0447 available by request