N-Butyl-4-methyl-N-nitroso-benzenesulfonamide
TL;DR: N-Butyl-4-methyl-N-nitroso-benzenesulfonamide (CAS 4347-80-2) is a chemical compound with molecular formula C11H16N2O3S and molecular weight 256.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-4-methyl-N-nitrosobenzenesulfonamide
Also Known As: n-butyl-4-methyl-n-nitrosobenzenesulfonamide, N-n-butyl-N-nitroso-4-toluenesulfonamide, N-BUTYL-4-METHYL-N-NITROSO-BENZENESULFONAMIDE, N-Butyl-4-methyl-N-nitrosobenzene-1-sulfonamide
| Molecular Formula | C11H16N2O3S |
|---|---|
| Molecular Weight | 256.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.08817 |
| Heavy Atoms | 17 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 4347-80-2 |
|---|---|
| SMILES | CCCCN(N=O)S(=O)(=O)C1=CC=C(C=C1)C |
| InChIKey | SOZQZSLFUQZZQZ-UHFFFAOYSA-N |
Product Overview
N-Butyl-4-methyl-N-nitroso-benzenesulfonamide (CAS 4347-80-2), with molecular formula C11H16N2O3S and molecular weight 256.09 g/mol. IUPAC: N-butyl-4-methyl-N-nitrosobenzenesulfonamide.
Chemical Property Profile of N-Butyl-4-methyl-N-nitroso-benzenesulfonamide
Property Insights of N-Butyl-4-methyl-N-nitroso-benzenesulfonamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Butyl-4-methyl-N-nitroso-benzenesulfonamide. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Butyl-4-methyl-N-nitroso-benzenesulfonamide. Following Lipinski's Rule of Five, N-Butyl-4-methyl-N-nitroso-benzenesulfonamide has 0 hydrogen bond donor(s) and 5 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-methyl-N-nitroso-benzenesulfonamide?
The CAS number of N-Butyl-4-methyl-N-nitroso-benzenesulfonamide is 4347-80-2.
What is the molecular formula of N-Butyl-4-methyl-N-nitroso-benzenesulfonamide?
The molecular formula of N-Butyl-4-methyl-N-nitroso-benzenesulfonamide is C11H16N2O3S.
What is the molecular weight of N-Butyl-4-methyl-N-nitroso-benzenesulfonamide?
The molecular weight of N-Butyl-4-methyl-N-nitroso-benzenesulfonamide is 256.09 g/mol.
Where can I buy N-Butyl-4-methyl-N-nitroso-benzenesulfonamide?
You can request a quote for N-Butyl-4-methyl-N-nitroso-benzenesulfonamide 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-methyl-N-nitroso-benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-Butyl-4-methyl-N-nitroso-benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.