2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate
TL;DR: 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate (CAS 339015-18-8) is a chemical compound with molecular formula C16H17NO3S and molecular weight 303.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylsulfinylphenyl)methyl N-(4-methylphenyl)carbamate
Also Known As: 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate, (2-methylsulfinylphenyl)methyl N-(4-methylphenyl)carbamate, (2-methanesulfinylphenyl)methyl N-(4-methylphenyl)carbamate, (2-methanesulfinylphenyl)methylN-(4-methylphenyl)carbamate
| Molecular Formula | C16H17NO3S |
|---|---|
| Molecular Weight | 303.09 g/mol |
| LogP | 3.48112 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.09293 |
| Heavy Atoms | 21 |
| Complexity | 652.8266 |
Chemical Identifiers
| CAS Number | 339015-18-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)OCC2=CC=CC=C2S(=O)C |
Product Overview
2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate (CAS 339015-18-8), with molecular formula C16H17NO3S and molecular weight 303.09 g/mol. IUPAC: (2-methylsulfinylphenyl)methyl N-(4-methylphenyl)carbamate.
Chemical Property Profile of 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate
Property Insights of 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate
The XLogP value of 3.48112 indicates that 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate has 1 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 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate?
The CAS number of 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate is 339015-18-8.
What is the molecular formula of 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate?
The molecular formula of 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate is C16H17NO3S.
What is the molecular weight of 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate?
The molecular weight of 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate is 303.09 g/mol.
Where can I buy 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate?
You can request a quote for 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-(methylsulfinyl)benzyl N-(4-methylphenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.