D187-0085 Screening compound: 1-cyclohexyl-1-(4-ethylphenyl)-3-(morpholin-4-yl)-2-phenylpropan-1-ol

D187-0085 Screening compound: 1-cyclohexyl-1-(4-ethylphenyl)-3-(morpholin-4-yl)-2-phenylpropan-1-ol
D187-0085 Screening compound: 1-cyclohexyl-1-(4-ethylphenyl)-3-(morpholin-4-yl)-2-phenylpropan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D187-0085
1-cyclohexyl-1-(4-ethylphenyl)-3-(morpholin-4-yl)-2-phenylpropan-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

D187-0085

Molecular Formula

C27H37NO2 (C27 H37 NO2)

Compound Name

1-cyclohexyl-1-(4-ethylphenyl)-3-(morpholin-4-yl)-2-phenylpropan-1-ol

IUPAC name

1-cyclohexyl-1-(4-ethylphenyl)-3-(morpholin-4-yl)-2-phenylpropan-1-ol

SMILES

CCc1ccc(C(C(CN2CCOCC2)c2ccccc2)(C2CCCCC2)O)cc1

InChI

InChI=1S/C27H37NO2/c1-2-22-13-15-25(16-14-22)27(29,24-11-7-4-8-12-24)26(23-9-5-3-6-10-23)21-28-17-19-30-20-18-28/h3,5-6,9-10,13-16,24,26,29H,2,4,7-8,11-12,17-21H2,1H3

InChI Key

MBOCKRYKCNJCRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14813736

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.6

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

6.115

Distribution Coefficient, logD

6.108

Water Solubility, LogSw

-5.44

Polar Surface Area

26.597

Acid Dissociation Constant (pKa)

15.49

Base Dissociation Constant (pKb)

5.56

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

55.60

D187-0085 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D187-0085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D187-0085?
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What is the minimum amount of D187-0085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D187-0085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D187-0085
  • 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 D187-0085 available by request