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Methanone, benzo[b]thien-3-yl(2-methylphenyl)-
TL;DR: Methanone, benzo[b]thien-3-yl(2-methylphenyl)- (CAS 22720-67-8) is a chemical compound with molecular formula C16H12OS and molecular weight 252.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzothiophen-3-yl-(2-methylphenyl)methanone
Also Known As: Ketone, benzo[b]thien-3-yl o-tolyl, Methanone, benzo[b]thien-3-yl(2-methylphenyl)-, Benzo[b]thiophen-3-yl(o-tolyl)methanone, Benzothiophene, 3-(2-methylbenzoyl)-, 1-benzothiophen-3-yl-(2-methylphenyl)methanone
| Molecular Formula | C16H12OS |
|---|---|
| Molecular Weight | 252.06 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.06088 |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 22720-67-8 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)C2=CSC3=CC=CC=C32 |
| InChIKey | CLJATIVWKLSDFE-UHFFFAOYSA-N |
Product Overview
Methanone, benzo[b]thien-3-yl(2-methylphenyl)- (CAS 22720-67-8), with molecular formula C16H12OS and molecular weight 252.06 g/mol. IUPAC: 1-benzothiophen-3-yl-(2-methylphenyl)methanone.
Chemical Property Profile of Methanone, benzo[b]thien-3-yl(2-methylphenyl)-
Property Insights of Methanone, benzo[b]thien-3-yl(2-methylphenyl)-
The XLogP value of 4.8 indicates that Methanone, benzo[b]thien-3-yl(2-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, Methanone, benzo[b]thien-3-yl(2-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, benzo[b]thien-3-yl(2-methylphenyl)- 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 Methanone, benzo[b]thien-3-yl(2-methylphenyl)-?
The CAS number of Methanone, benzo[b]thien-3-yl(2-methylphenyl)- is 22720-67-8.
What is the molecular formula of Methanone, benzo[b]thien-3-yl(2-methylphenyl)-?
The molecular formula of Methanone, benzo[b]thien-3-yl(2-methylphenyl)- is C16H12OS.
What is the molecular weight of Methanone, benzo[b]thien-3-yl(2-methylphenyl)-?
The molecular weight of Methanone, benzo[b]thien-3-yl(2-methylphenyl)- is 252.06 g/mol.
Where can I buy Methanone, benzo[b]thien-3-yl(2-methylphenyl)-?
You can request a quote for Methanone, benzo[b]thien-3-yl(2-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, benzo[b]thien-3-yl(2-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, benzo[b]thien-3-yl(2-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.