CAS RN: 35373-92-3

L-Phenylalanine methylamide

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Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250525 100mg / 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS35373-92-3
  • Purity/Analytical Methods: >99.0%
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35373-92-3 / 2-amino-N-methyl-3-phenylpropanamide

Standard CAS: 35373-92-3 Multi CAS: Yes

Basic Information

CAS
35373-92-3
Multi CAS
Yes
Molecular Formula
C10H14N2O
Molecular Weight
178.230000
Exact Mass
178.110613
InChI
InChI=1S/C10H14N2O/c1-12-10(13)9(11)7-8-5-3-2-4-6-8/h2-6,9H,7,11H2,1H3,(H,12,13)/t9-/m0/s1
InChIKey
BVRKOQJETMBIDK-VIFPVBQESA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
52.19
TPSA
55.12

LogP / Solubility

WLOGP
0.3
MLOGP
0.26
XLogP3
0.5
Consensus LogP
0.35
Log S (ESOL)
-1.28
Class (ESOL)
Soluble
Log S (Ali)
-1.24
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.43
Class (SILICOS-IT)
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)
-3.59

Drug-likeness / Medicinal Chemistry

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

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