n-Butyl-4-methylbenzenesulfinamide
TL;DR: n-Butyl-4-methylbenzenesulfinamide (CAS 6873-87-6) is a chemical compound with molecular formula C11H17NOS and molecular weight 211.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-4-methylbenzenesulfinamide
Also Known As: n-Butyl-4-methylbenzenesulfinamide, p-Toluolsulfinsaeure-butylamid, N-Butyl-p-toluenesulfinylamide, N-butyl-4-methylbenzene-1-sulfinamide, n-Butyl-4-methylbenzenesulfinamide #
| Molecular Formula | C11H17NOS |
|---|---|
| Molecular Weight | 211.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 211.10309 |
| Heavy Atoms | 14 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 6873-87-6 |
|---|---|
| SMILES | CCCCNS(=O)C1=CC=C(C=C1)C |
| InChIKey | RARIANANGFXCKL-UHFFFAOYSA-N |
Product Overview
n-Butyl-4-methylbenzenesulfinamide (CAS 6873-87-6), with molecular formula C11H17NOS and molecular weight 211.10 g/mol. IUPAC: N-butyl-4-methylbenzenesulfinamide.
Chemical Property Profile of n-Butyl-4-methylbenzenesulfinamide
Property Insights of n-Butyl-4-methylbenzenesulfinamide
The XLogP value of 3.1 indicates that n-Butyl-4-methylbenzenesulfinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.3 Ų, n-Butyl-4-methylbenzenesulfinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl-4-methylbenzenesulfinamide 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 n-Butyl-4-methylbenzenesulfinamide?
The CAS number of n-Butyl-4-methylbenzenesulfinamide is 6873-87-6.
What is the molecular formula of n-Butyl-4-methylbenzenesulfinamide?
The molecular formula of n-Butyl-4-methylbenzenesulfinamide is C11H17NOS.
What is the molecular weight of n-Butyl-4-methylbenzenesulfinamide?
The molecular weight of n-Butyl-4-methylbenzenesulfinamide is 211.10 g/mol.
Where can I buy n-Butyl-4-methylbenzenesulfinamide?
You can request a quote for n-Butyl-4-methylbenzenesulfinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Butyl-4-methylbenzenesulfinamide?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl-4-methylbenzenesulfinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.