E683-0325 Screening compound: N-{2-[(3-chlorophenyl)amino]-4-methylquinolin-6-yl}-3,4,5-triethoxybenzamide

E683-0325 Screening compound: N-{2-[(3-chlorophenyl)amino]-4-methylquinolin-6-yl}-3,4,5-triethoxybenzamide
E683-0325 Screening compound: N-{2-[(3-chlorophenyl)amino]-4-methylquinolin-6-yl}-3,4,5-triethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E683-0325
N-{2-[(3-chlorophenyl)amino]-4-methylquinolin-6-yl}-3,4,5-triethoxybenzamide

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

E683-0325

Molecular Formula

C29H30ClN3O4 (C29 H30 ClN3 O4)

Compound Name

N-{2-[(3-chlorophenyl)amino]-4-methylquinolin-6-yl}-3,4,5-triethoxybenzamide

IUPAC name

N-{2-[(3-chlorophenyl)amino]-4-methylquinolin-6-yl}-345-triethoxybenzamide

SMILES

CCOc1cc(C(Nc(cc2c(C)c3)ccc2nc3Nc2cccc(Cl)c2)=O)cc(OCC)c1OCC

InChI

InChI=1S/C29H30ClN3O4/c1-5-35-25-14-19(15-26(36-6-2)28(25)37-7-3)29(34)32-22-11-12-24-23(17-22)18(4)13-27(33-24)31-21-10-8-9-20(30)16-21/h8-17H,5-7H2,1-4H3,(H,31,33)(H,32,34)

InChI Key

UNDMTUOTCGBDNZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14909849

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

520.03

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

7.301

Distribution Coefficient, logD

7.301

Water Solubility, LogSw

-6.37

Polar Surface Area

62.857

Acid Dissociation Constant (pKa)

11.38

Base Dissociation Constant (pKb)

4.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.10

E683-0325 in Drug Discovery

Included in Screening Libraries

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

Lipid Metabolism Library (9174 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with E683-0325 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E683-0325?
Check Price and Availability of E683-0325, 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 E683-0325 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E683-0325
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E683-0325
  • 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 E683-0325 available by request