(Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one
TL;DR: (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one (CAS 338751-66-9) is a chemical compound with molecular formula C21H15NO3 and molecular weight 329.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-phenoxyphenyl)iminomethyl]-2-benzofuran-1-ol
Also Known As: (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one, 3-[(4-phenoxyphenyl)iminomethyl]-2-benzofuran-1-ol, 5D-034, 3-[(4-phenoxyanilino)methylidene]-2-benzofuran-1-one, (3Z)-3-{[(4-phenoxyphenyl)amino]methylidene}-1,3-dihydro-2-benzofuran-1-one
| Molecular Formula | C21H15NO3 |
|---|---|
| Molecular Weight | 329.11 g/mol |
| LogP | 5.6813 |
| Topological Polar Surface Area | 54.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.1052 |
| Heavy Atoms | 25 |
| Complexity | 1018.147 |
Chemical Identifiers
| CAS Number | 338751-66-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)N=CC3=C4C=CC=CC4=C(O3)O |
Product Overview
(Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one (CAS 338751-66-9), with molecular formula C21H15NO3 and molecular weight 329.11 g/mol. IUPAC: 3-[(4-phenoxyphenyl)iminomethyl]-2-benzofuran-1-ol.
Chemical Property Profile of (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one
Property Insights of (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one
The XLogP value of 5.6813 indicates that (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.96 Ų, (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-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 (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one?
The CAS number of (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one is 338751-66-9.
What is the molecular formula of (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one?
The molecular formula of (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one is C21H15NO3.
What is the molecular weight of (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one?
The molecular weight of (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one is 329.11 g/mol.
Where can I buy (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one?
You can request a quote for (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-((4-Phenoxyphenylamino)methylene)isobenzofuran-1(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.