C066-1040 Screening compound: N-(2-ethoxyphenyl)-2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamide

C066-1040 Screening compound: N-(2-ethoxyphenyl)-2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamide
C066-1040 Screening compound: N-(2-ethoxyphenyl)-2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-1040
N-(2-ethoxyphenyl)-2-(1-oxo-1,2-dihydroisoquinolin-2-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

C066-1040

Molecular Formula

C19H18N2O3 (C19 H18 N2 O3)

Compound Name

N-(2-ethoxyphenyl)-2-(1-oxo-1,2-dihydroisoquinolin-2-yl)acetamide

IUPAC name

N-(2-ethoxyphenyl)-2-(1-oxo-12-dihydroisoquinolin-2-yl)acetamide

SMILES

CCOc(cccc1)c1NC(CN(C=Cc1c2cccc1)C2=O)=O

InChI

InChI=1S/C19H18N2O3/c1-2-24-17-10-6-5-9-16(17)20-18(22)13-21-12-11-14-7-3-4-8-15(14)19(21)23/h3-12H,2,13H2,1H3,(H,20,22)

InChI Key

ZVFWKAWOTHZHHN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03449299

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.634

Distribution Coefficient, logD

2.634

Water Solubility, LogSw

-3.24

Polar Surface Area

45.343

Acid Dissociation Constant (pKa)

11.51

Base Dissociation Constant (pKb)

1.66

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

C066-1040 in Drug Discovery

Included in Screening Libraries

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with C066-1040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-1040?
Check Price and Availability of C066-1040, 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 C066-1040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-1040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-1040
  • 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 C066-1040 available by request