C129-0055 Screening compound: (2E)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-3-(4-methylphenyl)prop-2-enamide

C129-0055 Screening compound: (2E)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-3-(4-methylphenyl)prop-2-enamide
C129-0055 Screening compound: (2E)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-3-(4-methylphenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C129-0055
(2E)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-3-(4-methylphenyl)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

C129-0055

Molecular Formula

C26H29N3O (C26 H29 N3 O)

Compound Name

(2E)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-3-(4-methylphenyl)prop-2-enamide

IUPAC name

(2E)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]-3-(4-methylphenyl)prop-2-enamide

SMILES

CC(CC1)CCN1c1cc(C)c(cc(cc2)NC(/C=C/c3ccc(C)cc3)=O)c2n1

InChI

InChI=1S/C26H29N3O/c1-18-4-6-21(7-5-18)8-11-26(30)27-22-9-10-24-23(17-22)20(3)16-25(28-24)29-14-12-19(2)13-15-29/h4-11,16-17,19H,12-15H2,1-3H3,(H,27,30)

InChI Key

YMVOBHZLEAIINV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14721264

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.54

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.920

Distribution Coefficient, logD

6.918

Water Solubility, LogSw

-5.62

Polar Surface Area

34.363

Acid Dissociation Constant (pKa)

11.32

Base Dissociation Constant (pKb)

5.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.80

C129-0055 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C129-0055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C129-0055?
Check Price and Availability of C129-0055, 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 C129-0055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C129-0055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C129-0055
  • 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 C129-0055 available by request