1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine
TL;DR: 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine (CAS 681007-00-1) is a chemical compound with molecular formula C18H20Cl2N2O3S and molecular weight 414.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine
Also Known As: AO-081/42096484, 1-benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine, 1-benzyl-4-[(2,3-dichloro-4-methoxyphenyl)sulfonyl]piperazine, 4-[(4-benzyl-1-piperazinyl)sulfonyl]-2,3-dichlorophenyl methyl ether
| Molecular Formula | C18H20Cl2N2O3S |
|---|---|
| Molecular Weight | 414.06 g/mol |
| LogP | 3.5085 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.05716 |
| Heavy Atoms | 26 |
| Complexity | 867.505 |
Chemical Identifiers
| CAS Number | 681007-00-1 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)Cl)Cl |
Product Overview
1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine (CAS 681007-00-1), with molecular formula C18H20Cl2N2O3S and molecular weight 414.06 g/mol. IUPAC: 1-benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine.
Chemical Property Profile of 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine
Property Insights of 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine
The XLogP value of 3.5085 indicates that 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine has 0 hydrogen bond donor(s) and 4 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-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine?
The CAS number of 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine is 681007-00-1.
What is the molecular formula of 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine?
The molecular formula of 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine is C18H20Cl2N2O3S.
What is the molecular weight of 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine?
The molecular weight of 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine is 414.06 g/mol.
Where can I buy 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine?
You can request a quote for 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-4-(2,3-dichloro-4-methoxyphenyl)sulfonylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.