(1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine
TL;DR: (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine (CAS 435345-18-9) is a chemical compound with molecular formula C18H21NO and molecular weight 267.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine
Also Known As: BAS 00443070, Benzyl-[1-(4-methoxy-phenyl)-but-3-enyl]-amine, (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine
| Molecular Formula | C18H21NO |
|---|---|
| Molecular Weight | 267.16 g/mol |
| LogP | 4.1022 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 267.16232 |
| Heavy Atoms | 20 |
| Complexity | 518.8743 |
Chemical Identifiers
| CAS Number | 435345-18-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)[C@@H](CC=C)NCC2=CC=CC=C2 |
Product Overview
(1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine (CAS 435345-18-9), with molecular formula C18H21NO and molecular weight 267.16 g/mol. IUPAC: (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine.
Chemical Property Profile of (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine
Property Insights of (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine
The XLogP value of 4.1022 indicates that (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine has 1 hydrogen bond donor(s) and 2 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 (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine?
The CAS number of (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine is 435345-18-9.
What is the molecular formula of (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine?
The molecular formula of (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine is C18H21NO.
What is the molecular weight of (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine?
The molecular weight of (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine is 267.16 g/mol.
Where can I buy (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine?
You can request a quote for (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine?
Yes, KEHONG BIO provides custom synthesis services for (1R)-N-benzyl-1-(4-methoxyphenyl)but-3-en-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.