1778-0791 Screening compound: 4-(2,6-dimethoxybenzoyl)-2,6-dimethylmorpholine

1778-0791 Screening compound: 4-(2,6-dimethoxybenzoyl)-2,6-dimethylmorpholine
1778-0791 Screening compound: 4-(2,6-dimethoxybenzoyl)-2,6-dimethylmorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1778-0791
4-(2,6-dimethoxybenzoyl)-2,6-dimethylmorpholine

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

1778-0791

Molecular Formula

C15H21NO4 (C15 H21 NO4)

Compound Name

4-(2,6-dimethoxybenzoyl)-2,6-dimethylmorpholine

IUPAC name

4-(26-dimethoxybenzoyl)-26-dimethylmorpholine

SMILES

CC(C1)OC(C)CN1C(c(c(OC)ccc1)c1OC)=O

InChI

InChI=1S/C15H21NO4/c1-10-8-16(9-11(2)20-10)15(17)14-12(18-3)6-5-7-13(14)19-4/h5-7,10-11H,8-9H2,1-4H3

InChI Key

OWGMIPBVQNQXTE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01115718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

279.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.011

Distribution Coefficient, logD

1.011

Water Solubility, LogSw

-1.81

Polar Surface Area

39.080

Acid Dissociation Constant (pKa)

26.29

Base Dissociation Constant (pKb)

-2.87

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

53.30

1778-0791 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
  • Fragments

References: we are preparing a list of scientific research reports with 1778-0791 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1778-0791?
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What is the minimum amount of 1778-0791 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1778-0791
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1778-0791
  • 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 1778-0791 available by request