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Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone
TL;DR: Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone (CAS 339275-68-2) is a chemical compound with molecular formula C22H16O3S and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(benzenesulfinylmethyl)-1-benzofuran-2-yl]-phenylmethanone
Also Known As: 4J-574S, phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone, [3-(benzenesulfinylmethyl)-1-benzofuran-2-yl]-phenylmethanone, 2-benzoyl-3-[(benzenesulfinyl)methyl]-1-benzofuran, [3-(benzenesulfinylmethyl)benzofuran-2-yl]-phenyl-methanone
| Molecular Formula | C22H16O3S |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 4.9716 |
| Topological Polar Surface Area | 47.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.082 |
| Heavy Atoms | 26 |
| Complexity | 1082.2983 |
Chemical Identifiers
| CAS Number | 339275-68-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3O2)CS(=O)C4=CC=CC=C4 |
Product Overview
Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone (CAS 339275-68-2), with molecular formula C22H16O3S and molecular weight 360.08 g/mol. IUPAC: [3-(benzenesulfinylmethyl)-1-benzofuran-2-yl]-phenylmethanone.
Chemical Property Profile of Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone
Property Insights of Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone
The XLogP value of 4.9716 indicates that Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.28 Ų, Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone 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 Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone?
The CAS number of Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone is 339275-68-2.
What is the molecular formula of Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone?
The molecular formula of Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone is C22H16O3S.
What is the molecular weight of Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone?
The molecular weight of Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone is 360.08 g/mol.
Where can I buy Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone?
You can request a quote for Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone?
Yes, KEHONG BIO provides custom synthesis services for Phenyl{3-[(phenylsulfinyl)methyl]-1-benzofuran-2-yl}methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.