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2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one
TL;DR: 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one (CAS 6344-22-5) 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.
(2E)-2-(2-oxoacenaphthylen-1-ylidene)-1-benzothiophen-3-one
Also Known As: C.I.Vat Red 45, C.I.73860, 2-(2-oxoacenaphthylen-1(2h)-ylidene)-1-benzothiophen-3(2h)-one, (2E)-2-(2-oxoacenaphthylen-1-ylidene)-1-benzothiophen-3-one, 2-(1-Oxoacenaphthene-2-ylidene)benzo[b]thiophene-3(2H)-one
| Molecular Formula | C20H10O2S |
|---|---|
| Molecular Weight | 314.04 g/mol |
| LogP | 3.6067 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 314.04016 |
| Heavy Atoms | 23 |
| Complexity | 1218.4794 |
Chemical Identifiers
| CAS Number | 6344-22-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)/C(=C\3/C4=CC=CC5=C4C(=CC=C5)C3=O)/S2 |
Product Overview
2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one (CAS 6344-22-5), with molecular formula C20H10O2S and molecular weight 314.04 g/mol. IUPAC: (2E)-2-(2-oxoacenaphthylen-1-ylidene)-1-benzothiophen-3-one.
Chemical Property Profile of 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one
Property Insights of 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one
The XLogP value of 3.6067 indicates that 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-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-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one?
The CAS number of 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one is 6344-22-5.
What is the molecular formula of 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one?
The molecular formula of 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one is C20H10O2S.
What is the molecular weight of 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one?
The molecular weight of 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one is 314.04 g/mol.
Where can I buy 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one?
You can request a quote for 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-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-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Oxo-1(2H)-acenaphthylenylidene)benzo[b]thiophen-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.