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CAS 81771-86-0 (-)-(R)-Mexiletine hydrochloride molecular structure lightbox
CAS RN: 81771-86-0

(-)-(R)-Mexiletine hydrochloride

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260314 100mg / 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS81771-86-0
  • Purity/Analytical Methods: >99.0%
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81771-86-0 / 1-(2,6-dimethylphenoxy)propan-2-amine;hydrochloride

Standard CAS: 81771-86-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
81771-86-0
Multi CAS
Yes
Molecular Formula
C11H18CLNO
Molecular Weight
215.720000
Exact Mass
215.107692
InChI
InChI=1S/C11H17NO.ClH/c1-8-5-4-6-9(2)11(8)13-7-10(3)12;/h4-6,10H,7,12H2,1-3H3;1H/t10-;/m1./s1
InChIKey
NFEIBWMZVIVJLQ-HNCPQSOCSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
62.31
TPSA
35.25

LogP / Solubility

WLOGP
2.45
MLOGP
2.16
XLogP3
2.45
Consensus LogP
2.35
Log S (ESOL)
-2.84
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.1
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.46
Class (SILICOS-IT)
Poorly 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)
-2.3

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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