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3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one
TL;DR: 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one (CAS 10245-65-5) is a chemical compound with molecular formula C17H12OS and molecular weight 264.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-2-thiatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one
Also Known As: 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one, 2-phenyl-3H-naphtho[1,8-bc]thiophen-5(4H)-one, 5H-Naphtho[1,8-bc]thiophen-5-one, 3,4-dihydro-2-phenyl-, 3-phenyl-2-thiatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one, 2-Phenyl-3,4-dihydro-5H-naphtho[1,8-bc]thiophen-5-one
| Molecular Formula | C17H12OS |
|---|---|
| Molecular Weight | 264.06 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.06088 |
| Heavy Atoms | 19 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 10245-65-5 |
|---|---|
| SMILES | C1CC(=O)C2=C3C1=C(SC3=CC=C2)C4=CC=CC=C4 |
| InChIKey | XOSSMSJKOWZFRZ-UHFFFAOYSA-N |
Product Overview
3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one (CAS 10245-65-5), with molecular formula C17H12OS and molecular weight 264.06 g/mol. IUPAC: 3-phenyl-2-thiatricyclo[6.3.1.04,12]dodeca-1(11),3,8(12),9-tetraen-7-one.
Chemical Property Profile of 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one
Property Insights of 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one
The XLogP value of 4.3 indicates that 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one has 0 hydrogen bond donor(s) and 2 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 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one?
The CAS number of 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one is 10245-65-5.
What is the molecular formula of 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one?
The molecular formula of 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one is C17H12OS.
What is the molecular weight of 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one?
The molecular weight of 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one is 264.06 g/mol.
Where can I buy 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one?
You can request a quote for 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-2-phenyl-5H-naphtho[1,8-bc]thiophen-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.