D025-0047 Screening compound: 1-(4-bromophenyl)-3-(morpholin-4-yl)-1,2-diphenylpropan-1-ol

D025-0047 Screening compound: 1-(4-bromophenyl)-3-(morpholin-4-yl)-1,2-diphenylpropan-1-ol
D025-0047 Screening compound: 1-(4-bromophenyl)-3-(morpholin-4-yl)-1,2-diphenylpropan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D025-0047
1-(4-bromophenyl)-3-(morpholin-4-yl)-1,2-diphenylpropan-1-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

D025-0047

Molecular Formula

C25H26BrNO2 (C25 H26 BrNO2)

Compound Name

1-(4-bromophenyl)-3-(morpholin-4-yl)-1,2-diphenylpropan-1-ol

IUPAC name

1-(4-bromophenyl)-3-(morpholin-4-yl)-12-diphenylpropan-1-ol

SMILES

OC(C(CN1CCOCC1)c1ccccc1)(c1ccccc1)c(cc1)ccc1Br

InChI

InChI=1S/C25H26BrNO2/c26-23-13-11-22(12-14-23)25(28,21-9-5-2-6-10-21)24(20-7-3-1-4-8-20)19-27-15-17-29-18-16-27/h1-14,24,28H,15-19H2

InChI Key

GKWKQOZLNYGLLH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14811051

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

452.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.169

Distribution Coefficient, logD

5.151

Water Solubility, LogSw

-5.35

Polar Surface Area

26.405

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

6.02

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

28.00

D025-0047 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Autophagy-Targeted Library (4564 compounds)

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

CNS BBB Library (22607 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

References: we are preparing a list of scientific research reports with D025-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D025-0047?
Check Price and Availability of D025-0047, 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 D025-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D025-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D025-0047
  • 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 D025-0047 available by request