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CAS 3623-02-7 4-(2-Fluorophenoxy)piperidine molecular structure lightbox
CAS RN: 3623-02-7

4-(2-Fluorophenoxy)piperidine

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Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250326 100mg / 250mg / 500mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS3623-02-7
  • Purity/Analytical Methods: >99.0%
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3623-02-7 / 4-(2-fluorophenoxy)piperidine

Standard CAS: 3623-02-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
3623-02-7
Multi CAS
No
Molecular Formula
C11FH14NO
Molecular Weight
195.230000
Exact Mass
195.105942
InChI
InChI=1S/C11H14FNO/c12-10-3-1-2-4-11(10)14-9-5-7-13-8-6-9/h1-4,9,13H,5-8H2
InChIKey
MGLFLCJKTMPKSG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
52.92
TPSA
21.26

LogP / Solubility

WLOGP
1.96
MLOGP
1.72
XLogP3
2.1
Consensus LogP
1.93
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.57
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.79
Class (SILICOS-IT)
Moderately 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)
-2.52

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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