N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide
TL;DR: N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide (CAS 540517-49-5) is a chemical compound with molecular formula C18H23NO3S and molecular weight 333.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-methoxy-2-methyl-5-propan-2-ylbenzenesulfonamide
Also Known As: N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide, N-benzyl-4-methoxy-2-methyl-5-propan-2-ylbenzenesulfonamide, AO-080/42479728, N-benzyl-4-methoxy-2-methyl-5-(propan-2-yl)benzenesulfonamide, N-benzyl-4-methoxy-2-methyl-5-(propan-2-yl)benzene-1-sulfonamide
| Molecular Formula | C18H23NO3S |
|---|---|
| Molecular Weight | 333.14 g/mol |
| LogP | 3.60552 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.13986 |
| Heavy Atoms | 23 |
| Complexity | 768.35376 |
Chemical Identifiers
| CAS Number | 540517-49-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1S(=O)(=O)NCC2=CC=CC=C2)C(C)C)OC |
Product Overview
N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide (CAS 540517-49-5), with molecular formula C18H23NO3S and molecular weight 333.14 g/mol. IUPAC: N-benzyl-4-methoxy-2-methyl-5-propan-2-ylbenzenesulfonamide.
Chemical Property Profile of N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide
Property Insights of N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide
The XLogP value of 3.60552 indicates that N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide 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-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide?
The CAS number of N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide is 540517-49-5.
What is the molecular formula of N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide?
The molecular formula of N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide is C18H23NO3S.
What is the molecular weight of N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide?
The molecular weight of N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide is 333.14 g/mol.
Where can I buy N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide?
You can request a quote for N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-5-isopropyl-4-methoxy-2-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.