C126-0106 Screening compound: (2E)-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamide

C126-0106 Screening compound: (2E)-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamide
C126-0106 Screening compound: (2E)-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C126-0106
(2E)-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-(4-ethoxy-3-methoxyphenyl)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

C126-0106

Molecular Formula

C26H31N3O3 (C26 H31 N3 O3)

Compound Name

(2E)-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamide

IUPAC name

(2E)-N-[2-(diethylamino)-4-methylquinolin-6-yl]-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamide

SMILES

CCN(CC)c1cc(C)c(cc(cc2)NC(/C=C/c(cc3)cc(OC)c3OCC)=O)c2n1

InChI

InChI=1S/C26H31N3O3/c1-6-29(7-2)25-15-18(4)21-17-20(11-12-22(21)28-25)27-26(30)14-10-19-9-13-23(32-8-3)24(16-19)31-5/h9-17H,6-8H2,1-5H3,(H,27,30)

InChI Key

SUKFCPQLUZZYJC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14721092

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

433.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.946

Distribution Coefficient, logD

5.944

Water Solubility, LogSw

-5.64

Polar Surface Area

48.487

Acid Dissociation Constant (pKa)

11.32

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

C126-0106 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Antiviral Annotated Library (21441 compounds)

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

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 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

References: we are preparing a list of scientific research reports with C126-0106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C126-0106?
Check Price and Availability of C126-0106, 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 C126-0106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C126-0106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C126-0106
  • 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 C126-0106 available by request