G817-0306 Screening compound: 1-(morpholin-4-yl)-4-(morpholine-4-carbonyl)isoquinoline

G817-0306 Screening compound: 1-(morpholin-4-yl)-4-(morpholine-4-carbonyl)isoquinoline
G817-0306 Screening compound: 1-(morpholin-4-yl)-4-(morpholine-4-carbonyl)isoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound G817-0306
1-(morpholin-4-yl)-4-(morpholine-4-carbonyl)isoquinoline

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

G817-0306

Molecular Formula

C18H21N3O3 (C18 H21 N3 O3)

Compound Name

1-(morpholin-4-yl)-4-(morpholine-4-carbonyl)isoquinoline

IUPAC name

1-(morpholin-4-yl)-4-(morpholine-4-carbonyl)isoquinoline

SMILES

O=C(c(c1ccccc11)cnc1N1CCOCC1)N1CCOCC1

InChI

InChI=1S/C18H21N3O3/c22-18(21-7-11-24-12-8-21)16-13-19-17(20-5-9-23-10-6-20)15-4-2-1-3-14(15)16/h1-4,13H,5-12H2

InChI Key

SMFVHRTWWYIITF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15038737

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.634

Distribution Coefficient, logD

1.625

Water Solubility, LogSw

-2.14

Polar Surface Area

44.955

Acid Dissociation Constant (pKa)

23.86

Base Dissociation Constant (pKb)

5.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.40

G817-0306 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with G817-0306 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G817-0306?
Check Price and Availability of G817-0306, 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 G817-0306 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G817-0306
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G817-0306
  • 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 G817-0306 available by request