2190-0065 Screening compound: 4-[9-(4-hydroxy-3-methoxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]-2-methoxyphenol

2190-0065 Screening compound: 4-[9-(4-hydroxy-3-methoxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]-2-methoxyphenol
2190-0065 Screening compound: 4-[9-(4-hydroxy-3-methoxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]-2-methoxyphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 2190-0065
4-[9-(4-hydroxy-3-methoxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]-2-methoxyphenol

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

2190-0065

Molecular Formula

C21H24O8 (C21 H24 O8)

Compound Name

4-[9-(4-hydroxy-3-methoxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-3-yl]-2-methoxyphenol

IUPAC name

4-[9-(4-hydroxy-3-methoxyphenyl)-24810-tetraoxaspiro[5.5]undecan-3-yl]-2-methoxyphenol

SMILES

COc(cc(C(OC1)OCC11COC(c(cc2)cc(OC)c2O)OC1)cc1)c1O

InChI

InChI=1S/C21H24O8/c1-24-17-7-13(3-5-15(17)22)19-26-9-21(10-27-19)11-28-20(29-12-21)14-4-6-16(23)18(8-14)25-2/h3-8,19-20,22-23H,9-12H2,1-2H3

InChI Key

JLWUEHGSGOOEDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01077598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.42

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.486

Distribution Coefficient, logD

1.484

Water Solubility, LogSw

-1.72

Polar Surface Area

83.148

Acid Dissociation Constant (pKa)

9.82

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

2190-0065 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Glucocorticoid receptors Library (4806 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 2190-0065 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2190-0065?
Check Price and Availability of 2190-0065, 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 2190-0065 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2190-0065
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2190-0065
  • 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 2190-0065 available by request