1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine
TL;DR: 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine (CAS 670255-87-5) is a chemical compound with molecular formula C18H29NO2S and molecular weight 323.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine
Also Known As: 1-(5-tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine, AQ-390/42122742, 1-[(5-tert-butyl-2,3-dimethylphenyl)sulfonyl]-4-methylpiperidine
| Molecular Formula | C18H29NO2S |
|---|---|
| Molecular Weight | 323.19 g/mol |
| LogP | 4.02154 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.1919 |
| Heavy Atoms | 22 |
| Complexity | 648.4001 |
Chemical Identifiers
| CAS Number | 670255-87-5 |
|---|---|
| SMILES | CC1CCN(CC1)S(=O)(=O)C2=C(C(=CC(=C2)C(C)(C)C)C)C |
Product Overview
1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine (CAS 670255-87-5), with molecular formula C18H29NO2S and molecular weight 323.19 g/mol. IUPAC: 1-(5-tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine.
Chemical Property Profile of 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine
Property Insights of 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine
The XLogP value of 4.02154 indicates that 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine has 0 hydrogen bond donor(s) and 2 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 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine?
The CAS number of 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine is 670255-87-5.
What is the molecular formula of 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine?
The molecular formula of 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine is C18H29NO2S.
What is the molecular weight of 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine?
The molecular weight of 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine is 323.19 g/mol.
Where can I buy 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine?
You can request a quote for 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Tert-butyl-2,3-dimethylphenyl)sulfonyl-4-methylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.