D173-0046 Screening compound: 3-(4-fluorophenyl)-5-methyl-1-(morpholin-4-yl)-2-phenylhexan-3-ol

D173-0046 Screening compound: 3-(4-fluorophenyl)-5-methyl-1-(morpholin-4-yl)-2-phenylhexan-3-ol
D173-0046 Screening compound: 3-(4-fluorophenyl)-5-methyl-1-(morpholin-4-yl)-2-phenylhexan-3-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D173-0046
3-(4-fluorophenyl)-5-methyl-1-(morpholin-4-yl)-2-phenylhexan-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

D173-0046

Molecular Formula

C23H30FNO2 (C23 H30 FNO2)

Compound Name

3-(4-fluorophenyl)-5-methyl-1-(morpholin-4-yl)-2-phenylhexan-3-ol

IUPAC name

3-(4-fluorophenyl)-5-methyl-1-(morpholin-4-yl)-2-phenylhexan-3-ol

SMILES

CC(C)CC(C(CN1CCOCC1)c1ccccc1)(c(cc1)ccc1F)O

InChI

InChI=1S/C23H30FNO2/c1-18(2)16-23(26,20-8-10-21(24)11-9-20)22(19-6-4-3-5-7-19)17-25-12-14-27-15-13-25/h3-11,18,22,26H,12-17H2,1-2H3

InChI Key

RAKKOPCNRKBQSG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14813581

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

371.5

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.521

Distribution Coefficient, logD

4.504

Water Solubility, LogSw

-4.14

Polar Surface Area

27.144

Acid Dissociation Constant (pKa)

14.99

Base Dissociation Constant (pKb)

5.98

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

47.80

D173-0046 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D173-0046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D173-0046?
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What is the minimum amount of D173-0046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D173-0046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D173-0046
  • 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 D173-0046 available by request