0570-0075 Screening compound: (2E)-3-(3,4-DIMETHOXYPHENYL)-N-(4-METHOXYPHENYL)-N-{8-METHYL-8-AZABICYCLO[3.2.1]OCT-2-EN-3-YL}PROP-2-ENAMIDE

0570-0075 Screening compound: (2E)-3-(3,4-DIMETHOXYPHENYL)-N-(4-METHOXYPHENYL)-N-{8-METHYL-8-AZABICYCLO[3.2.1]OCT-2-EN-3-YL}PROP-2-ENAMIDE
0570-0075 Screening compound: (2E)-3-(3,4-DIMETHOXYPHENYL)-N-(4-METHOXYPHENYL)-N-{8-METHYL-8-AZABICYCLO[3.2.1]OCT-2-EN-3-YL}PROP-2-ENAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound 0570-0075
(2E)-3-(3,4-DIMETHOXYPHENYL)-N-(4-METHOXYPHENYL)-N-{8-METHYL-8-AZABICYCLO[3.2.1]OCT-2-EN-3-YL}PROP-2-ENAMIDE

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

0570-0075

Molecular Formula

C26H30N2O4 (C26 H30 N2 O4)

Compound Name

(2E)-3-(3,4-DIMETHOXYPHENYL)-N-(4-METHOXYPHENYL)-N-{8-METHYL-8-AZABICYCLO[3.2.1]OCT-2-EN-3-YL}PROP-2-ENAMIDE

IUPAC name

n/a

SMILES

CN(C(CC1)C2)C1C=C2N(C(/C=C/c(cc1)cc(OC)c1OC)=O)c(cc1)ccc1OC

InChI

InChI=1S/C26H30N2O4/c1-27-20-7-8-21(27)17-22(16-20)28(19-9-11-23(30-2)12-10-19)26(29)14-6-18-5-13-24(31-3)25(15-18)32-4/h5-6,9-16,20-21H,7-8,17H2,1-4H3

InChI Key

UYZXPQOEHKNFNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00333042

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

434.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.503

Distribution Coefficient, logD

1.919

Water Solubility, LogSw

-3.73

Polar Surface Area

40.621

Acid Dissociation Constant (pKa)

27.22

Base Dissociation Constant (pKb)

8.97

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

34.60

0570-0075 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Structure:
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0570-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0570-0075?
Check Price and Availability of 0570-0075, 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 0570-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0570-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0570-0075
  • 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 0570-0075 available by request