4092-0903 Screening compound: 2,6-dimethoxy-4-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)phenol

4092-0903 Screening compound: 2,6-dimethoxy-4-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)phenol
4092-0903 Screening compound: 2,6-dimethoxy-4-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 4092-0903
2,6-dimethoxy-4-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)phenol

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

4092-0903

Molecular Formula

C23H32N2O6 (C23 H32 N2 O6)

Compound Name

2,6-dimethoxy-4-({4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)phenol

IUPAC name

26-dimethoxy-4-({4-[(234-trimethoxyphenyl)methyl]piperazin-1-yl}methyl)phenol

SMILES

COc1ccc(CN2CCN(Cc(cc3OC)cc(OC)c3O)CC2)c(OC)c1OC

InChI

InChI=1S/C23H32N2O6/c1-27-18-7-6-17(22(30-4)23(18)31-5)15-25-10-8-24(9-11-25)14-16-12-19(28-2)21(26)20(13-16)29-3/h6-7,12-13,26H,8-11,14-15H2,1-5H3

InChI Key

OFMJTVUADODLPK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02213256

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

432.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.856

Distribution Coefficient, logD

-0.515

Water Solubility, LogSw

-2.12

Polar Surface Area

61.316

Acid Dissociation Constant (pKa)

9.41

Base Dissociation Constant (pKb)

10.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.80

4092-0903 in Drug Discovery

Included in Screening Libraries

Glucocorticoid receptors Library (4806 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4092-0903 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4092-0903?
Check Price and Availability of 4092-0903, 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 4092-0903 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4092-0903
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4092-0903
  • 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 4092-0903 available by request