2-(Benzenesulfonyl)-1-methylnaphthalene
TL;DR: 2-(Benzenesulfonyl)-1-methylnaphthalene (CAS 94540-87-1) is a chemical compound with molecular formula C17H14O2S and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-1-methylnaphthalene
Also Known As: 2-(benzenesulfonyl)-1-methylnaphthalene
| Molecular Formula | C17H14O2S |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 282.07144 |
| Heavy Atoms | 20 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 94540-87-1 |
|---|---|
| SMILES | CC1=C(C=CC2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | HEZOQLYDTYXVCV-UHFFFAOYSA-N |
Product Overview
2-(Benzenesulfonyl)-1-methylnaphthalene (CAS 94540-87-1), with molecular formula C17H14O2S and molecular weight 282.07 g/mol. IUPAC: 2-(benzenesulfonyl)-1-methylnaphthalene.
Chemical Property Profile of 2-(Benzenesulfonyl)-1-methylnaphthalene
Property Insights of 2-(Benzenesulfonyl)-1-methylnaphthalene
The XLogP value of 4.3 indicates that 2-(Benzenesulfonyl)-1-methylnaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 2-(Benzenesulfonyl)-1-methylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzenesulfonyl)-1-methylnaphthalene 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 2-(Benzenesulfonyl)-1-methylnaphthalene?
The CAS number of 2-(Benzenesulfonyl)-1-methylnaphthalene is 94540-87-1.
What is the molecular formula of 2-(Benzenesulfonyl)-1-methylnaphthalene?
The molecular formula of 2-(Benzenesulfonyl)-1-methylnaphthalene is C17H14O2S.
What is the molecular weight of 2-(Benzenesulfonyl)-1-methylnaphthalene?
The molecular weight of 2-(Benzenesulfonyl)-1-methylnaphthalene is 282.07 g/mol.
Where can I buy 2-(Benzenesulfonyl)-1-methylnaphthalene?
You can request a quote for 2-(Benzenesulfonyl)-1-methylnaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzenesulfonyl)-1-methylnaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzenesulfonyl)-1-methylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.