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CAS 3438-14-0 H-ALA-4M-BETANA HCL molecular structure lightbox
CAS RN: 3438-14-0

H-ALA-4M-BETANA HCL

Product Availability

Available package options are listed below.

1 package records0 with current stock
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250331 250mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS3438-14-0
  • Purity/Analytical Methods: >99.0%
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3438-14-0 / (2S)-2-amino-N-(4-methoxynaphthalen-2-yl)propanamide;hydrochloride

Standard CAS: 3438-14-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
3438-14-0
Multi CAS
Yes
Molecular Formula
C14H17CLN2O2
Molecular Weight
280.750000
Exact Mass
280.097856
InChI
InChI=1S/C14H16N2O2.ClH/c1-9(15)14(17)16-11-7-10-5-3-4-6-12(10)13(8-11)18-2;/h3-9H,15H2,1-2H3,(H,16,17);1H/t9-;/m0./s1
InChIKey
ZEKFPQBOUDNNNH-FVGYRXGTSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
10
Fraction Csp3
0.21
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
2
Molar refractivity
80.03
TPSA
64.35

LogP / Solubility

WLOGP
2.56
MLOGP
2.26
XLogP3
2.56
Consensus LogP
2.46
Log S (ESOL)
-3.38
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.71
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.97
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.62

Drug-likeness / Medicinal Chemistry

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

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