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CAS 23396-50-1 3-HYDROXY-3-PHENYL-PIPERIDINE molecular structure lightbox
CAS RN: 23396-50-1

3-HYDROXY-3-PHENYL-PIPERIDINE

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260422 10mg / 100mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS23396-50-1
  • Purity/Analytical Methods: >99.0%
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23396-50-1 / 3-phenylpiperidin-3-ol

Standard CAS: 23396-50-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
23396-50-1
Multi CAS
No
Molecular Formula
C11H15NO
Molecular Weight
177.240000
Exact Mass
177.115364
SMILES
C1CC(CNC1)(C2=CC=CC=C2)O
InChI
InChI=1S/C11H15NO/c13-11(7-4-8-12-9-11)10-5-2-1-3-6-10/h1-3,5-6,12-13H,4,7-9H2
InChIKey
KJBQDFYSFZZSMZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
52.44
TPSA
32.26

LogP / Solubility

WLOGP
1.26
MLOGP
1.1
XLogP3
1
Consensus LogP
1.12
Log S (ESOL)
-2.01
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.92
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.98
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.91

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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