2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine
TL;DR: 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine (CAS 650592-83-9) is a chemical compound with molecular formula C22H25N5O4S and molecular weight 455.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine
Also Known As: 2-benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine
| Molecular Formula | C22H25N5O4S |
|---|---|
| Molecular Weight | 455.16 g/mol |
| LogP | 3.52064 |
| Topological Polar Surface Area | 114.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.16272 |
| Heavy Atoms | 32 |
| Complexity | 1171.7457 |
Chemical Identifiers
| CAS Number | 650592-83-9 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N/C(=N\S(=O)(=O)CC2=CC=CC=C2)/NC3=CC(=CC(=C3)OC)OC)C |
Product Overview
2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine (CAS 650592-83-9), with molecular formula C22H25N5O4S and molecular weight 455.16 g/mol. IUPAC: 2-benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine.
Chemical Property Profile of 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine
Property Insights of 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine
The XLogP value of 3.52064 indicates that 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine. Following Lipinski's Rule of Five, 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine has 2 hydrogen bond donor(s) and 6 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 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine?
The CAS number of 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine is 650592-83-9.
What is the molecular formula of 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine?
The molecular formula of 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine is C22H25N5O4S.
What is the molecular weight of 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine?
The molecular weight of 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine is 455.16 g/mol.
Where can I buy 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine?
You can request a quote for 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylsulfonyl-1-(3,5-dimethoxyphenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.