(3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one
TL;DR: (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one (CAS 100046-84-2) is a chemical compound with molecular formula C15H9ClO2S and molecular weight 288.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2-one
Also Known As: BIM-0038169.P001, (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one, 5-(4-chlorophenyl)-3-(2-thienylmethylene)furan-2-one, 5-(4-chlorophenyl)-3-(2-thienylmethylene)-2(3H)-furanone, 5-(4-Chloro-phenyl)-3-thiophen-2-ylmethylene-3H-furan-2-one
| Molecular Formula | C15H9ClO2S |
|---|---|
| Molecular Weight | 288.00 g/mol |
| LogP | 4.3828 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.0012 |
| Heavy Atoms | 19 |
| Complexity | 666.68097 |
Chemical Identifiers
| CAS Number | 100046-84-2 |
|---|---|
| SMILES | C1=CSC(=C1)/C=C/2\C=C(OC2=O)C3=CC=C(C=C3)Cl |
Product Overview
(3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one (CAS 100046-84-2), with molecular formula C15H9ClO2S and molecular weight 288.00 g/mol. IUPAC: (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2-one.
Chemical Property Profile of (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one
Property Insights of (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one
The XLogP value of 4.3828 indicates that (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one has 0 hydrogen bond donor(s) and 3 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 (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one?
The CAS number of (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one is 100046-84-2.
What is the molecular formula of (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one?
The molecular formula of (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one is C15H9ClO2S.
What is the molecular weight of (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one?
The molecular weight of (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one is 288.00 g/mol.
Where can I buy (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one?
You can request a quote for (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for (3E)-5-(4-chlorophenyl)-3-(thiophen-2-ylmethylidene)furan-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.