2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one
TL;DR: 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one (CAS 312726-66-2) is a chemical compound with molecular formula C14H7Cl2NO2S and molecular weight 322.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-2-(3,4-dichlorophenyl)-4-(thiophen-2-ylmethylidene)-1,3-oxazol-5-one
Also Known As: 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one, AN-465/12848042, (4Z)-2-(3,4-dichlorophenyl)-4-(thiophen-2-ylmethylidene)-1,3-oxazol-5-one, 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazolin-5-one, (4Z)-2-(3,4-DICHLOROPHENYL)-4-[(THIOPHEN-2-YL)METHYLIDENE]-4,5-DIHYDRO-1,3-OXAZOL-5-ONE
| Molecular Formula | C14H7Cl2NO2S |
|---|---|
| Molecular Weight | 322.96 g/mol |
| LogP | 4.3994 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.95746 |
| Heavy Atoms | 20 |
| Complexity | 735.6371 |
Chemical Identifiers
| CAS Number | 312726-66-2 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C\2/C(=O)OC(=N2)C3=CC(=C(C=C3)Cl)Cl |
Product Overview
2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one (CAS 312726-66-2), with molecular formula C14H7Cl2NO2S and molecular weight 322.96 g/mol. IUPAC: (4Z)-2-(3,4-dichlorophenyl)-4-(thiophen-2-ylmethylidene)-1,3-oxazol-5-one.
Chemical Property Profile of 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one
Property Insights of 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one
The XLogP value of 4.3994 indicates that 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-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 38.66 Ų, 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one has 0 hydrogen bond donor(s) and 4 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 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one?
The CAS number of 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one is 312726-66-2.
What is the molecular formula of 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one?
The molecular formula of 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one is C14H7Cl2NO2S.
What is the molecular weight of 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one?
The molecular weight of 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one is 322.96 g/mol.
Where can I buy 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one?
You can request a quote for 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-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-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-dichlorophenyl)-4-(2-thienylmethylene)-1,3-oxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.