1-(4-Methylbenzenesulfonyl)-2-phenylaziridine
TL;DR: 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine (CAS 62596-62-7) is a chemical compound with molecular formula C15H15NO2S and molecular weight 273.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonyl-2-phenylaziridine
Also Known As: 2-phenyl-1-tosylaziridine, 1-(4-methylbenzenesulfonyl)-2-phenylaziridine, 1-[(4-Methylphenyl)sulfonyl]-2-phenylaziridine, 2-phenyl-n-tosylaziridine, N-Tosyl-2-phenylaziridine
| Molecular Formula | C15H15NO2S |
|---|---|
| Molecular Weight | 273.08 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.08234 |
| Heavy Atoms | 19 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 62596-62-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CC2C3=CC=CC=C3 |
| InChIKey | KUWCTOOXSUPLAW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Methylbenzenesulfonyl)-2-phenylaziridine (CAS 62596-62-7), with molecular formula C15H15NO2S and molecular weight 273.08 g/mol. IUPAC: 1-(4-methylphenyl)sulfonyl-2-phenylaziridine.
Chemical Property Profile of 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine
Property Insights of 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine. With a topological polar surface area (TPSA) of 45.5 Ų, 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine 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 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine?
The CAS number of 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine is 62596-62-7.
What is the molecular formula of 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine?
The molecular formula of 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine is C15H15NO2S.
What is the molecular weight of 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine?
The molecular weight of 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine is 273.08 g/mol.
Where can I buy 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine?
You can request a quote for 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methylbenzenesulfonyl)-2-phenylaziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.