3-(4-Phenyl-1,3-butadienyl)phenylamine
TL;DR: 3-(4-Phenyl-1,3-butadienyl)phenylamine (CAS 887572-48-7) is a chemical compound with molecular formula C16H15N and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(1E,3E)-4-phenylbuta-1,3-dienyl]aniline
Also Known As: 3-(4-phenyl-1,3-butadienyl)phenylamine, 3-[(1E,3E)-4-phenylbuta-1,3-dienyl]aniline, 3-(4-Phenyl-1,3-butadien-1-yl)benzenamine, AB-131/42301477, 3-((1E,3E)-4-Phenylbuta-1,3-dien-1-yl)aniline
| Molecular Formula | C16H15N |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 3.9954 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.12045 |
| Heavy Atoms | 17 |
| Complexity | 524.23126 |
Chemical Identifiers
| CAS Number | 887572-48-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C=C/C2=CC(=CC=C2)N |
Product Overview
3-(4-Phenyl-1,3-butadienyl)phenylamine (CAS 887572-48-7), with molecular formula C16H15N and molecular weight 221.12 g/mol. IUPAC: 3-[(1E,3E)-4-phenylbuta-1,3-dienyl]aniline.
Chemical Property Profile of 3-(4-Phenyl-1,3-butadienyl)phenylamine
Property Insights of 3-(4-Phenyl-1,3-butadienyl)phenylamine
The XLogP value of 3.9954 indicates that 3-(4-Phenyl-1,3-butadienyl)phenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.02 Ų, 3-(4-Phenyl-1,3-butadienyl)phenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Phenyl-1,3-butadienyl)phenylamine 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 3-(4-Phenyl-1,3-butadienyl)phenylamine?
The CAS number of 3-(4-Phenyl-1,3-butadienyl)phenylamine is 887572-48-7.
What is the molecular formula of 3-(4-Phenyl-1,3-butadienyl)phenylamine?
The molecular formula of 3-(4-Phenyl-1,3-butadienyl)phenylamine is C16H15N.
What is the molecular weight of 3-(4-Phenyl-1,3-butadienyl)phenylamine?
The molecular weight of 3-(4-Phenyl-1,3-butadienyl)phenylamine is 221.12 g/mol.
Where can I buy 3-(4-Phenyl-1,3-butadienyl)phenylamine?
You can request a quote for 3-(4-Phenyl-1,3-butadienyl)phenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Phenyl-1,3-butadienyl)phenylamine?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Phenyl-1,3-butadienyl)phenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.