CAS RN: 135065-70-2

(R)-2-((benzyloxy)methyl)morpholine(WXC06858)

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Batchno.20250521 50mg / 250mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS135065-70-2
  • Purity/Analytical Methods: >99.0%
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135065-70-2 / (2R)-2-(phenylmethoxymethyl)morpholine

Standard CAS: 135065-70-2 Multi CAS: No

Basic Information

CAS
135065-70-2
Multi CAS
No
Molecular Formula
C12H17NO2
Molecular Weight
207.270000
Exact Mass
207.125929
SMILES
C1CO[C@H](CN1)COCC2=CC=CC=C2
InChI
InChI=1S/C12H17NO2/c1-2-4-11(5-3-1)9-14-10-12-8-13-6-7-15-12/h1-5,12-13H,6-10H2/t12-/m1/s1
InChIKey
LMONFJPVVMPUTF-GFCCVEGCSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
1
Molar refractivity
58.71
TPSA
30.49

LogP / Solubility

WLOGP
1.19
MLOGP
1.05
XLogP3
0.8
Consensus LogP
1.01
Log S (ESOL)
-1.91
Class (ESOL)
Soluble
Log S (Ali)
-2.12
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.48
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)
-3.14

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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