Mesyloxybenzyl isobutylbenzenesulfonamide
TL;DR: Mesyloxybenzyl isobutylbenzenesulfonamide (CAS 853758-16-4) is a chemical compound with molecular formula C18H23NO5S2 and molecular weight 397.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[[benzenesulfonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate
Also Known As: Mesyloxybenzyl isobutylbenzenesulfonamide, Mesyloxybenzyl isobutylbenzenesulfonamide [INCI], N-(4-Mesyloxybenzyl)-N-isobutylbenzenesulfonamide, mibsa, Benzenesulfonamide, N-(2-methylpropyl)-N-((4-((methylsulfonyl)oxy)phenyl)methyl)-, [4-[[benzenesulfonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate
| Molecular Formula | C18H23NO5S2 |
|---|---|
| Molecular Weight | 397.10 g/mol |
| LogP | 2.8719 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.10178 |
| Heavy Atoms | 26 |
| Complexity | 921.3066 |
Chemical Identifiers
| CAS Number | 853758-16-4 |
|---|---|
| SMILES | CC(C)CN(CC1=CC=C(C=C1)OS(=O)(=O)C)S(=O)(=O)C2=CC=CC=C2 |
Product Overview
Mesyloxybenzyl isobutylbenzenesulfonamide (CAS 853758-16-4), with molecular formula C18H23NO5S2 and molecular weight 397.10 g/mol. IUPAC: [4-[[benzenesulfonyl(2-methylpropyl)amino]methyl]phenyl] methanesulfonate.
Chemical Property Profile of Mesyloxybenzyl isobutylbenzenesulfonamide
Property Insights of Mesyloxybenzyl isobutylbenzenesulfonamide
The XLogP value of 2.8719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mesyloxybenzyl isobutylbenzenesulfonamide. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Mesyloxybenzyl isobutylbenzenesulfonamide. Following Lipinski's Rule of Five, Mesyloxybenzyl isobutylbenzenesulfonamide 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 Mesyloxybenzyl isobutylbenzenesulfonamide?
The CAS number of Mesyloxybenzyl isobutylbenzenesulfonamide is 853758-16-4.
What is the molecular formula of Mesyloxybenzyl isobutylbenzenesulfonamide?
The molecular formula of Mesyloxybenzyl isobutylbenzenesulfonamide is C18H23NO5S2.
What is the molecular weight of Mesyloxybenzyl isobutylbenzenesulfonamide?
The molecular weight of Mesyloxybenzyl isobutylbenzenesulfonamide is 397.10 g/mol.
Where can I buy Mesyloxybenzyl isobutylbenzenesulfonamide?
You can request a quote for Mesyloxybenzyl isobutylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mesyloxybenzyl isobutylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for Mesyloxybenzyl isobutylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.