6786-9306 Screening compound: methyl 4-{1-[(4-fluorophenyl)methyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate

6786-9306 Screening compound: methyl 4-{1-[(4-fluorophenyl)methyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate
6786-9306 Screening compound: methyl 4-{1-[(4-fluorophenyl)methyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6786-9306
methyl 4-{1-[(4-fluorophenyl)methyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}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

6786-9306

Molecular Formula

C25H22FNO5 (C25 H22 FNO5)

Compound Name

methyl 4-{1-[(4-fluorophenyl)methyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate

IUPAC name

methyl 4-{1-[(4-fluorophenyl)methyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate

SMILES

COC(c1ccc(C(C2Oc(cc3)ccc3OC)N(Cc(cc3)ccc3F)C2=O)cc1)=O

InChI

InChI=1S/C25H22FNO5/c1-30-20-11-13-21(14-12-20)32-23-22(17-5-7-18(8-6-17)25(29)31-2)27(24(23)28)15-16-3-9-19(26)10-4-16/h3-14,22-23H,15H2,1-2H3

InChI Key

JPTMQBPNEPHVIH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060388

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.312

Distribution Coefficient, logD

4.312

Water Solubility, LogSw

-4.37

Polar Surface Area

51.119

Acid Dissociation Constant (pKa)

21.22

Base Dissociation Constant (pKb)

-4.38

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

20.00

6786-9306 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6786-9306 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6786-9306?
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What is the minimum amount of 6786-9306 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6786-9306
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6786-9306
  • 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 6786-9306 available by request