CAS RN: 914348-90-6

2-(6-METHOXYNAPHTHALEN-2-YL)PIPERAZINE

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Batchno.20250202 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS914348-90-6
  • Purity/Analytical Methods: >99.0%
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914348-90-6 / 2-(6-methoxynaphthalen-2-yl)piperazine

Standard CAS: 914348-90-6 Multi CAS: No

Basic Information

CAS
914348-90-6
Multi CAS
No
Molecular Formula
C15H18N2O
Molecular Weight
242.320000
Exact Mass
242.141913
InChI
InChI=1S/C15H18N2O/c1-18-14-5-4-11-8-13(3-2-12(11)9-14)15-10-16-6-7-17-15/h2-5,8-9,15-17H,6-7,10H2,1H3
InChIKey
SYUWRDAXXXDWND-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
10
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
74.11
TPSA
33.29

LogP / Solubility

WLOGP
2.08
MLOGP
1.84
XLogP3
1.9
Consensus LogP
1.94
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.05
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.2
Class (SILICOS-IT)
Poorly 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)
-2.72

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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