C387-0727 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-ethoxyphenyl)amino]quinoline-4-carboxamide

C387-0727 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-ethoxyphenyl)amino]quinoline-4-carboxamide
C387-0727 Screening compound: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-ethoxyphenyl)amino]quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C387-0727
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-ethoxyphenyl)amino]quinoline-4-carboxamide

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

C387-0727

Molecular Formula

C28H29N3O4 (C28 H29 N3 O4)

Compound Name

N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-ethoxyphenyl)amino]quinoline-4-carboxamide

IUPAC name

N-[2-(34-dimethoxyphenyl)ethyl]-2-[(4-ethoxyphenyl)amino]quinoline-4-carboxamide

SMILES

CCOc(cc1)ccc1Nc1nc2ccccc2c(C(NCCc(cc2)cc(OC)c2OC)=O)c1

InChI

InChI=1S/C28H29N3O4/c1-4-35-21-12-10-20(11-13-21)30-27-18-23(22-7-5-6-8-24(22)31-27)28(32)29-16-15-19-9-14-25(33-2)26(17-19)34-3/h5-14,17-18H,4,15-16H2,1-3H3,(H,29,32)(H,30,31)

InChI Key

AAFHCZMJNPEDKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14755463

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.56

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

5.183

Distribution Coefficient, logD

5.183

Water Solubility, LogSw

-5.22

Polar Surface Area

64.688

Acid Dissociation Constant (pKa)

14.94

Base Dissociation Constant (pKb)

4.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.40

C387-0727 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with C387-0727 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C387-0727?
Check Price and Availability of C387-0727, 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 C387-0727 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C387-0727
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C387-0727
  • 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 C387-0727 available by request