6786-9290 Screening compound: methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate

6786-9290 Screening compound: methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate
6786-9290 Screening compound: methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6786-9290
methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-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

6786-9290

Molecular Formula

C28H29NO7 (C28 H29 NO7)

Compound Name

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

IUPAC name

methyl 4-{1-[2-(34-dimethoxyphenyl)ethyl]-3-(4-methoxyphenoxy)-4-oxoazetidin-2-yl}benzoate

SMILES

COC(c1ccc(C(C2Oc(cc3)ccc3OC)N(CCc(cc3)cc(OC)c3OC)C2=O)cc1)=O

InChI

InChI=1S/C28H29NO7/c1-32-21-10-12-22(13-11-21)36-26-25(19-6-8-20(9-7-19)28(31)35-4)29(27(26)30)16-15-18-5-14-23(33-2)24(17-18)34-3/h5-14,17,25-26H,15-16H2,1-4H3

InChI Key

NJTVDSRJSONYRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04060280

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.269

Distribution Coefficient, logD

4.269

Water Solubility, LogSw

-4.32

Polar Surface Area

66.358

Acid Dissociation Constant (pKa)

21.53

Base Dissociation Constant (pKb)

-2.45

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

28.60

6786-9290 in Drug Discovery

Included in Screening Libraries

Human Receptors Annotated Library (5376 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 6786-9290 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6786-9290?
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What is the minimum amount of 6786-9290 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6786-9290
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6786-9290
  • 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 6786-9290 available by request