(E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one
TL;DR: (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one (CAS 88991-47-3) is a chemical compound with molecular formula C14H9NO2S and molecular weight 255.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-2-phenyl-4-(thiophen-3-ylmethylidene)-1,3-oxazol-5-one
Also Known As: J3.247.349K, methyl Z-2-benzamido-3-(3-thienyl)propenoate, 2-Phenyl-4-(3-thenylidene)oxazole-5(4H)-one, (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one, (4E)-2-phenyl-4-(thiophen-3-ylmethylidene)-1,3-oxazol-5-one
| Molecular Formula | C14H9NO2S |
|---|---|
| Molecular Weight | 255.04 g/mol |
| LogP | 3.0926 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.0354 |
| Heavy Atoms | 18 |
| Complexity | 627.0783 |
Chemical Identifiers
| CAS Number | 88991-47-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=N/C(=C/C3=CSC=C3)/C(=O)O2 |
Product Overview
(E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one (CAS 88991-47-3), with molecular formula C14H9NO2S and molecular weight 255.04 g/mol. IUPAC: (4E)-2-phenyl-4-(thiophen-3-ylmethylidene)-1,3-oxazol-5-one.
Chemical Property Profile of (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one
Property Insights of (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one
The XLogP value of 3.0926 indicates that (E)-2-Phenyl-4-(thiophen-3-ylmethylene)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, (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-Phenyl-4-(thiophen-3-ylmethylene)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 (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one?
The CAS number of (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one is 88991-47-3.
What is the molecular formula of (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one?
The molecular formula of (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one is C14H9NO2S.
What is the molecular weight of (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one?
The molecular weight of (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one is 255.04 g/mol.
Where can I buy (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one?
You can request a quote for (E)-2-Phenyl-4-(thiophen-3-ylmethylene)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 (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-Phenyl-4-(thiophen-3-ylmethylene)oxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.