8008-5179 Screening compound: ethyl 3-[2-(morpholin-4-yl)acetamido]-1-benzofuran-2-carboxylate

8008-5179 Screening compound: ethyl 3-[2-(morpholin-4-yl)acetamido]-1-benzofuran-2-carboxylate
8008-5179 Screening compound: ethyl 3-[2-(morpholin-4-yl)acetamido]-1-benzofuran-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-5179
ethyl 3-[2-(morpholin-4-yl)acetamido]-1-benzofuran-2-carboxylate

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

8008-5179

Molecular Formula

C17H20N2O5 (C17 H20 N2 O5)

Compound Name

ethyl 3-[2-(morpholin-4-yl)acetamido]-1-benzofuran-2-carboxylate

IUPAC name

ethyl 3-[2-(morpholin-4-yl)acetamido]-1-benzofuran-2-carboxylate

SMILES

CCOC(c(oc1c2cccc1)c2NC(CN1CCOCC1)=O)=O

InChI

InChI=1S/C17H20N2O5/c1-2-23-17(21)16-15(12-5-3-4-6-13(12)24-16)18-14(20)11-19-7-9-22-10-8-19/h3-6H,2,7-11H2,1H3,(H,18,20)

InChI Key

ANSPUMORNITVIS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01305208

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.36

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.177

Distribution Coefficient, logD

1.944

Water Solubility, LogSw

-2.68

Polar Surface Area

62.913

Acid Dissociation Constant (pKa)

7.55

Base Dissociation Constant (pKb)

3.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.20

8008-5179 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS MPO Library (28609 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 8008-5179 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-5179?
Check Price and Availability of 8008-5179, 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 8008-5179 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-5179
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-5179
  • 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 8008-5179 available by request