![1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one structure](/static/products/116/1164531-63-8.png)
1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one
TL;DR: 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one (CAS 1164531-63-8) is a chemical compound with molecular formula C20H23NO3 and molecular weight 325.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[4-(3-methoxyphenoxy)anilino]-4,4-dimethylpent-1-en-3-one
Also Known As: 1-[4-(3-methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one, AH-487/41735971, (E)-1-[4-(3-methoxyphenoxy)anilino]-4,4-dimethylpent-1-en-3-one
| Molecular Formula | C20H23NO3 |
|---|---|
| Molecular Weight | 325.17 g/mol |
| LogP | 5.0283 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 325.1678 |
| Heavy Atoms | 24 |
| Complexity | 712.409 |
Chemical Identifiers
| CAS Number | 1164531-63-8 |
|---|---|
| SMILES | CC(C)(C)C(=O)/C=C/NC1=CC=C(C=C1)OC2=CC=CC(=C2)OC |
Product Overview
1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one (CAS 1164531-63-8), with molecular formula C20H23NO3 and molecular weight 325.17 g/mol. IUPAC: (E)-1-[4-(3-methoxyphenoxy)anilino]-4,4-dimethylpent-1-en-3-one.
Chemical Property Profile of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one
Property Insights of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one
The XLogP value of 5.0283 indicates that 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one?
The CAS number of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one is 1164531-63-8.
What is the molecular formula of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one?
The molecular formula of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one is C20H23NO3.
What is the molecular weight of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one?
The molecular weight of 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one is 325.17 g/mol.
Where can I buy 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one?
You can request a quote for 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(3-Methoxyphenoxy)anilino]-4,4-dimethyl-1-penten-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.