D104-0028 Screening compound: 3-(4-ethoxyphenyl)-6-methyl-1-(morpholin-4-yl)-2-phenylheptan-3-ol

D104-0028 Screening compound: 3-(4-ethoxyphenyl)-6-methyl-1-(morpholin-4-yl)-2-phenylheptan-3-ol
D104-0028 Screening compound: 3-(4-ethoxyphenyl)-6-methyl-1-(morpholin-4-yl)-2-phenylheptan-3-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D104-0028
3-(4-ethoxyphenyl)-6-methyl-1-(morpholin-4-yl)-2-phenylheptan-3-ol

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

D104-0028

Molecular Formula

C26H37NO3 (C26 H37 NO3)

Compound Name

3-(4-ethoxyphenyl)-6-methyl-1-(morpholin-4-yl)-2-phenylheptan-3-ol

IUPAC name

3-(4-ethoxyphenyl)-6-methyl-1-(morpholin-4-yl)-2-phenylheptan-3-ol

SMILES

CCOc1ccc(C(CCC(C)C)(C(CN2CCOCC2)c2ccccc2)O)cc1

InChI

InChI=1S/C26H37NO3/c1-4-30-24-12-10-23(11-13-24)26(28,15-14-21(2)3)25(22-8-6-5-7-9-22)20-27-16-18-29-19-17-27/h5-13,21,25,28H,4,14-20H2,1-3H3

InChI Key

AGMZYQRFQBWYMA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811850

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

411.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.272

Distribution Coefficient, logD

5.255

Water Solubility, LogSw

-5.21

Polar Surface Area

34.267

Acid Dissociation Constant (pKa)

15.10

Base Dissociation Constant (pKb)

6.00

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

53.80

D104-0028 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Autophagy-Targeted Library (4564 compounds)

CNS Targets (44014 compounds)

CNS targets activity set (6557 compounds)

Cardiovascular Library (22201 compounds)

Human GPCR Annotated Library (5539 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
Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Cardiovascular

References: we are preparing a list of scientific research reports with D104-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D104-0028?
Check Price and Availability of D104-0028, 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 D104-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D104-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D104-0028
  • 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 D104-0028 available by request