E679-0388 Screening compound: N~4~-(2-methyl-1-oxo-1,2-dihydro-4-isoquinolinyl)-4-morpholinecarboxamide

E679-0388 Screening compound: N~4~-(2-methyl-1-oxo-1,2-dihydro-4-isoquinolinyl)-4-morpholinecarboxamide
E679-0388 Screening compound: N~4~-(2-methyl-1-oxo-1,2-dihydro-4-isoquinolinyl)-4-morpholinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E679-0388
N~4~-(2-methyl-1-oxo-1,2-dihydro-4-isoquinolinyl)-4-morpholinecarboxamide

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

E679-0388

Molecular Formula

C15H17N3O3 (C15 H17 N3 O3)

Compound Name

N~4~-(2-methyl-1-oxo-1,2-dihydro-4-isoquinolinyl)-4-morpholinecarboxamide

IUPAC name

n/a

SMILES

CN(C=C(c1c2cccc1)NC(N1CCOCC1)=O)C2=O

InChI

InChI=1S/C15H17N3O3/c1-17-10-13(11-4-2-3-5-12(11)14(17)19)16-15(20)18-6-8-21-9-7-18/h2-5,10H,6-9H2,1H3,(H,16,20)

InChI Key

JLLDQXKDJOWCJV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27601034

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

287.32

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.280

Distribution Coefficient, logD

0.266

Water Solubility, LogSw

-2.10

Polar Surface Area

50.528

Acid Dissociation Constant (pKa)

8.87

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

E679-0388 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Fragments Library (11262 compounds)

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with E679-0388 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E679-0388?
Check Price and Availability of E679-0388, 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 E679-0388 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E679-0388
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E679-0388
  • 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 E679-0388 available by request