CAS RN: 1363408-43-8

(R)-3-(4-FLUOROPHENYL)MORPHOLINE HCL

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Batchno.20250923 100mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS1363408-43-8
  • Purity/Analytical Methods: >99.0%
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1363408-43-8 / (3R)-3-(4-fluorophenyl)morpholine;hydrochloride

Standard CAS: 1363408-43-8 Multi CAS: No

Basic Information

CAS
1363408-43-8
Multi CAS
No
Molecular Formula
C10H13ClFNO
Molecular Weight
217.670000
Exact Mass
217.066970
SMILES
C1COC[C@H](N1)C2=CC=C(C=C2)F.Cl
InChI
InChI=1S/C10H12FNO.ClH/c11-9-3-1-8(2-4-9)10-7-13-6-5-12-10;/h1-4,10,12H,5-7H2;1H/t10-;/m0./s1
InChIKey
WMGZVNCXNNRNNF-PPHPATTJSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.4
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
55.21
TPSA
21.26

LogP / Solubility

WLOGP
1.91
MLOGP
1.68
XLogP3
1.91
Consensus LogP
1.83
Log S (ESOL)
-2.64
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.72
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.78
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)
-2.69

Drug-likeness / Medicinal Chemistry

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

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