5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine
TL;DR: 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine (CAS 887453-58-9) is a chemical compound with molecular formula C11H17N3O2S and molecular weight 255.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methylsulfonyl-2-piperazin-1-ylaniline
Also Known As: 5-methylsulfonyl-2-piperazin-1-ylaniline, 5-methylsulfonyl-2-piperazin-1-yl-aniline, 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine, 5-(Methanesulfonyl)-2-(piperazin-1-yl)aniline
| Molecular Formula | C11H17N3O2S |
|---|---|
| Molecular Weight | 255.10 g/mol |
| LogP | 0.0819 |
| Topological Polar Surface Area | 75.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.10414 |
| Heavy Atoms | 17 |
| Complexity | 507.44788 |
Chemical Identifiers
| CAS Number | 887453-58-9 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=C(C=C1)N2CCNCC2)N |
Product Overview
5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine (CAS 887453-58-9), with molecular formula C11H17N3O2S and molecular weight 255.10 g/mol. IUPAC: 5-methylsulfonyl-2-piperazin-1-ylaniline.
Chemical Property Profile of 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine
Property Insights of 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine
The XLogP value of 0.0819 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine. The TPSA of 75.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine. Following Lipinski's Rule of Five, 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine has 2 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 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine?
The CAS number of 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine is 887453-58-9.
What is the molecular formula of 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine?
The molecular formula of 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine is C11H17N3O2S.
What is the molecular weight of 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine?
The molecular weight of 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine is 255.10 g/mol.
Where can I buy 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine?
You can request a quote for 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine?
Yes, KEHONG BIO provides custom synthesis services for 5-(Methylsulfonyl)-2-(1-piperazinyl)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.