N-苄基苯乙胺
TL;DR: N-苄基苯乙胺 (CAS 3647-71-0) is a chemical compound with molecular formula C15H17N and molecular weight 211.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-苄基苯乙胺
N-benzyl-2-phenylethanamine
Also Known As: Benethamine, N-Benzyl-2-phenylethanamine, N-Benzyl-2-phenylethylamine, N-Benzylphenethylamine, N-Benzyl-2-phenethylamine
| Molecular Formula | C15H17N |
|---|---|
| Molecular Weight | 211.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 211.1361 |
| Heavy Atoms | 16 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 3647-71-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNCC2=CC=CC=C2 |
| InChIKey | UPABQMWFWCMOFV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-苄基苯乙胺 (CAS 3647-71-0), with molecular formula C15H17N and molecular weight 211.14 g/mol. IUPAC: N-benzyl-2-phenylethanamine.
Chemical Property Profile of N-苄基苯乙胺
Property Insights of N-苄基苯乙胺
The XLogP value of 3.2 indicates that N-苄基苯乙胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-苄基苯乙胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-苄基苯乙胺 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-苄基苯乙胺?
The CAS number of N-苄基苯乙胺 is 3647-71-0.
What is the molecular formula of N-苄基苯乙胺?
The molecular formula of N-苄基苯乙胺 is C15H17N.
What is the molecular weight of N-苄基苯乙胺?
The molecular weight of N-苄基苯乙胺 is 211.14 g/mol.
Where can I buy N-苄基苯乙胺?
You can request a quote for N-苄基苯乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-苄基苯乙胺?
Yes, KEHONG BIO provides custom synthesis services for N-苄基苯乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.