2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one
TL;DR: 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one (CAS 6252-78-4) is a chemical compound with molecular formula C20H10O2S and molecular weight 314.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxoacenaphthylen-1-ylidene)-1-benzothiophen-3-one
Also Known As: 2-(2-oxoacenaphthylen-1-ylidene)-1-benzothiophen-3-one, 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one, 2-(2-oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one, sodium 2-[3-(4-sulfonato-o-tolyliminio)-6-o-toluidino-3H-xanthen-9-yl]benzoate
| Molecular Formula | C20H10O2S |
|---|---|
| Molecular Weight | 314.04 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 314.04016 |
| Heavy Atoms | 23 |
| Complexity | 592.0 |
Chemical Identifiers
| CAS Number | 6252-78-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C(=C3C4=CC=CC5=C4C(=CC=C5)C3=O)S2 |
| InChIKey | UFLQLEHQELUPJU-UHFFFAOYSA-N |
Product Overview
2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one (CAS 6252-78-4), with molecular formula C20H10O2S and molecular weight 314.04 g/mol. IUPAC: 2-(2-oxoacenaphthylen-1-ylidene)-1-benzothiophen-3-one.
Chemical Property Profile of 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one
Property Insights of 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one
The XLogP value of 4.7 indicates that 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.4 Ų, 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-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 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one?
The CAS number of 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one is 6252-78-4.
What is the molecular formula of 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one?
The molecular formula of 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one is C20H10O2S.
What is the molecular weight of 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one?
The molecular weight of 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one is 314.04 g/mol.
Where can I buy 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one?
You can request a quote for 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-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-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.