2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one
TL;DR: 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one (CAS 353472-07-8) is a chemical compound with molecular formula C20H17ClINO4 and molecular weight 496.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-2-(2-chloro-5-iodophenyl)-4-[(3,4-diethoxyphenyl)methylidene]-1,3-oxazol-5-one
Also Known As: 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one, (4Z)-2-(2-chloro-5-iodophenyl)-4-[(3,4-diethoxyphenyl)methylidene]-1,3-oxazol-5-one, (4Z)-2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one, 2-(2-CHLORO-5-IODOPHENYL)-4-[(Z)-1-(3,4-DIETHOXYPHENYL)METHYLIDENE]-1,3-OXAZOL-5-ONE
| Molecular Formula | C20H17ClINO4 |
|---|---|
| Molecular Weight | 496.99 g/mol |
| LogP | 5.0865 |
| Topological Polar Surface Area | 57.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.98907 |
| Heavy Atoms | 27 |
| Complexity | 939.5741 |
Chemical Identifiers
| CAS Number | 353472-07-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)/C=C\2/C(=O)OC(=N2)C3=C(C=CC(=C3)I)Cl)OCC |
Product Overview
2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one (CAS 353472-07-8), with molecular formula C20H17ClINO4 and molecular weight 496.99 g/mol. IUPAC: (4Z)-2-(2-chloro-5-iodophenyl)-4-[(3,4-diethoxyphenyl)methylidene]-1,3-oxazol-5-one.
Chemical Property Profile of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one
Property Insights of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one
The XLogP value of 5.0865 indicates that 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.12 Ų, 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one?
The CAS number of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one is 353472-07-8.
What is the molecular formula of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one?
The molecular formula of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one is C20H17ClINO4.
What is the molecular weight of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one?
The molecular weight of 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one is 496.99 g/mol.
Where can I buy 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one?
You can request a quote for 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-chloro-5-iodophenyl)-4-(3,4-diethoxybenzylidene)-1,3-oxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.