N-butyl-3-phenylprop-2-en-1-imine
TL;DR: N-butyl-3-phenylprop-2-en-1-imine (CAS 15286-55-2) is a chemical compound with molecular formula C13H17N and molecular weight 187.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-3-phenylprop-2-en-1-imine
Also Known As: N-butyl-3-phenylprop-2-en-1-imine, 1-Butanamine, N-(3-phenyl-2-propenylidene)-, (1E)-N-Butyl-3-phenylprop-2-en-1-imine, 1-Butanamine,N-(3-phenyl-2-propenylidene)
| Molecular Formula | C13H17N |
|---|---|
| Molecular Weight | 187.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 187.1361 |
| Heavy Atoms | 14 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 15286-55-2 |
|---|---|
| SMILES | CCCCN=CC=CC1=CC=CC=C1 |
| InChIKey | XQAXOKLIOHMDIN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-butyl-3-phenylprop-2-en-1-imine (CAS 15286-55-2), with molecular formula C13H17N and molecular weight 187.14 g/mol. IUPAC: N-butyl-3-phenylprop-2-en-1-imine.
Chemical Property Profile of N-butyl-3-phenylprop-2-en-1-imine
Property Insights of N-butyl-3-phenylprop-2-en-1-imine
The XLogP value of 3.2 indicates that N-butyl-3-phenylprop-2-en-1-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, N-butyl-3-phenylprop-2-en-1-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-3-phenylprop-2-en-1-imine has 0 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-butyl-3-phenylprop-2-en-1-imine?
The CAS number of N-butyl-3-phenylprop-2-en-1-imine is 15286-55-2.
What is the molecular formula of N-butyl-3-phenylprop-2-en-1-imine?
The molecular formula of N-butyl-3-phenylprop-2-en-1-imine is C13H17N.
What is the molecular weight of N-butyl-3-phenylprop-2-en-1-imine?
The molecular weight of N-butyl-3-phenylprop-2-en-1-imine is 187.14 g/mol.
Where can I buy N-butyl-3-phenylprop-2-en-1-imine?
You can request a quote for N-butyl-3-phenylprop-2-en-1-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-3-phenylprop-2-en-1-imine?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-3-phenylprop-2-en-1-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.