G898-0828 Screening compound: 2-(3,4-diethoxyphenyl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]acetamide

G898-0828 Screening compound: 2-(3,4-diethoxyphenyl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]acetamide
G898-0828 Screening compound: 2-(3,4-diethoxyphenyl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G898-0828
2-(3,4-diethoxyphenyl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]acetamide

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

G898-0828

Molecular Formula

C28H35N3O3 (C28 H35 N3 O3)

Compound Name

2-(3,4-diethoxyphenyl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]acetamide

IUPAC name

2-(34-diethoxyphenyl)-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]acetamide

SMILES

CCOc(ccc(CC(Nc1cc2c(C)cc(N3CCC(C)CC3)nc2cc1)=O)c1)c1OCC

InChI

InChI=1S/C28H35N3O3/c1-5-33-25-10-7-21(16-26(25)34-6-2)17-28(32)29-22-8-9-24-23(18-22)20(4)15-27(30-24)31-13-11-19(3)12-14-31/h7-10,15-16,18-19H,5-6,11-14,17H2,1-4H3,(H,29,32)

InChI Key

BRMIADRRNZYUAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15074482

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.818

Distribution Coefficient, logD

5.818

Water Solubility, LogSw

-5.60

Polar Surface Area

48.783

Acid Dissociation Constant (pKa)

10.74

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

G898-0828 in Drug Discovery

Included in Screening Libraries

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

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with G898-0828 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G898-0828?
Check Price and Availability of G898-0828, 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 G898-0828 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G898-0828
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G898-0828
  • 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 G898-0828 available by request