8020-5178 Screening compound: bis({2-methoxy-5-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy})phosphinic acid

8020-5178 Screening compound: bis({2-methoxy-5-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy})phosphinic acid
8020-5178 Screening compound: bis({2-methoxy-5-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy})phosphinic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-5178
bis({2-methoxy-5-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy})phosphinic acid

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

8020-5178

Molecular Formula

C36H39O12P (C36 H39 O12 P)

Compound Name

bis({2-methoxy-5-[(1Z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenoxy})phosphinic acid

IUPAC name

bis({2-methoxy-5-[(1Z)-2-(345-trimethoxyphenyl)ethenyl]phenoxy})phosphinic acid

SMILES

COc(ccc(/C=C\c(cc1OC)cc(OC)c1OC)c1)c1OP(O)(Oc(cc(/C=C\c(cc1OC)cc(OC)c1OC)cc1)c1OC)=O

InChI

InChI=1S/C36H39O12P/c1-39-27-15-13-23(9-11-25-19-31(41-3)35(45-7)32(20-25)42-4)17-29(27)47-49(37,38)48-30-18-24(14-16-28(30)40-2)10-12-26-21-33(43-5)36(46-8)34(22-26)44-6/h9-22H,1-8H3,(H,37,38)

InChI Key

LGHWAVMLXPICRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD25976033

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

694.67

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

5.665

Distribution Coefficient, logD

-0.142

Water Solubility, LogSw

-5.70

Polar Surface Area

105.753

Acid Dissociation Constant (pKa)

1.59

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

8020-5178 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8020-5178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-5178?
Check Price and Availability of 8020-5178, 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 8020-5178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-5178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-5178
  • 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 8020-5178 available by request