2-(Benzenesulfonyl)-3-phenyloxaziridine
TL;DR: 2-(Benzenesulfonyl)-3-phenyloxaziridine (CAS 69849-45-2) is a chemical compound with molecular formula C13H11NO3S and molecular weight 261.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzenesulfonyl)-3-phenyloxaziridine
Also Known As: 3-Phenyl-2-(phenylsulfonyl)-1,2-oxaziridine, Davis oxaziridine, 2-(benzenesulfonyl)-3-phenyloxaziridine, Davis reagent, cis-6-Nonenal
| Molecular Formula | C13H11NO3S |
|---|---|
| Molecular Weight | 261.05 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.04596 |
| Heavy Atoms | 18 |
| Complexity | 378.0 |
Chemical Identifiers
| CAS Number | 69849-45-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2N(O2)S(=O)(=O)C3=CC=CC=C3 |
| InChIKey | MKHGVMIXRPGHOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Benzenesulfonyl)-3-phenyloxaziridine (CAS 69849-45-2), with molecular formula C13H11NO3S and molecular weight 261.05 g/mol. IUPAC: 2-(benzenesulfonyl)-3-phenyloxaziridine.
Chemical Property Profile of 2-(Benzenesulfonyl)-3-phenyloxaziridine
Property Insights of 2-(Benzenesulfonyl)-3-phenyloxaziridine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Benzenesulfonyl)-3-phenyloxaziridine. With a topological polar surface area (TPSA) of 58.1 Ų, 2-(Benzenesulfonyl)-3-phenyloxaziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzenesulfonyl)-3-phenyloxaziridine has 0 hydrogen bond donor(s) and 4 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)-3-phenyloxaziridine?
The CAS number of 2-(Benzenesulfonyl)-3-phenyloxaziridine is 69849-45-2.
What is the molecular formula of 2-(Benzenesulfonyl)-3-phenyloxaziridine?
The molecular formula of 2-(Benzenesulfonyl)-3-phenyloxaziridine is C13H11NO3S.
What is the molecular weight of 2-(Benzenesulfonyl)-3-phenyloxaziridine?
The molecular weight of 2-(Benzenesulfonyl)-3-phenyloxaziridine is 261.05 g/mol.
Where can I buy 2-(Benzenesulfonyl)-3-phenyloxaziridine?
You can request a quote for 2-(Benzenesulfonyl)-3-phenyloxaziridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzenesulfonyl)-3-phenyloxaziridine?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzenesulfonyl)-3-phenyloxaziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.