8015-1856 Screening compound: (E)-3-(3,4-dimethoxyphenyl)-N~1~-[4-(2-morpholino-2-oxoethoxy)phenyl]-2-propenamide

8015-1856 Screening compound: (E)-3-(3,4-dimethoxyphenyl)-N~1~-[4-(2-morpholino-2-oxoethoxy)phenyl]-2-propenamide
8015-1856 Screening compound: (E)-3-(3,4-dimethoxyphenyl)-N~1~-[4-(2-morpholino-2-oxoethoxy)phenyl]-2-propenamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-1856
(E)-3-(3,4-dimethoxyphenyl)-N~1~-[4-(2-morpholino-2-oxoethoxy)phenyl]-2-propenamide

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

8015-1856

Molecular Formula

C23H26N2O6 (C23 H26 N2 O6)

Compound Name

(E)-3-(3,4-dimethoxyphenyl)-N~1~-[4-(2-morpholino-2-oxoethoxy)phenyl]-2-propenamide

IUPAC name

(2E)-3-(34-dimethoxyphenyl)-N-{4-[2-(morpholin-4-yl)-2-oxoethoxy]phenyl}prop-2-enamide

SMILES

COc(ccc(/C=C/C(Nc(cc1)ccc1OCC(N1CCOCC1)=O)=O)c1)c1OC

InChI

InChI=1S/C23H26N2O6/c1-28-20-9-3-17(15-21(20)29-2)4-10-22(26)24-18-5-7-19(8-6-18)31-16-23(27)25-11-13-30-14-12-25/h3-10,15H,11-14,16H2,1-2H3,(H,24,26)

InChI Key

DTNZXWHEMAZXIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03854769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

426.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.939

Distribution Coefficient, logD

1.938

Water Solubility, LogSw

-2.68

Polar Surface Area

69.906

Acid Dissociation Constant (pKa)

12.35

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.43

8015-1856 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8015-1856 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-1856?
Check Price and Availability of 8015-1856, 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 8015-1856 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-1856
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-1856
  • 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 8015-1856 available by request