CAS RN: 351490-95-4
2-(2-Methyl-2-aminopropyl)naphthalene hydrochloride
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20251206 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS351490-95-4
- Purity/Analytical Methods: >99.0%
351490-95-4 / 2-methyl-1-naphthalen-2-ylpropan-2-amine;hydrochloride
Basic Information
CAS
351490-95-4
Multi CAS
No
Molecular Formula
C14H18CLN
Molecular Weight
235.750000
Exact Mass
235.112777
InChI
InChI=1S/C14H17N.ClH/c1-14(2,15)10-11-7-8-12-5-3-4-6-13(12)9-11;/h3-9H,10,15H2,1-2H3;1H
InChIKey
ORVVZYBFFPBNBJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
10
Fraction Csp3
0.29
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
73.17
TPSA
26.02
LogP / Solubility
WLOGP
3.54
MLOGP
3.12
XLogP3
3.54
Consensus LogP
3.4
Log S (ESOL)
-3.86
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.05
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.37
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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