N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide
TL;DR: N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide (CAS 869075-50-3) is a chemical compound with molecular formula C18H23N3O4S and molecular weight 377.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonylguanidine
Also Known As: N'-[2-(3,4-dimethoxyphenyl)ethyl]-N-(4-methylbenzenesulfonyl)guanidine, F1857-0190, 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonylguanidine, N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide, 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonyl-guanidine
| Molecular Formula | C18H23N3O4S |
|---|---|
| Molecular Weight | 377.14 g/mol |
| LogP | 1.84792 |
| Topological Polar Surface Area | 103.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 377.14093 |
| Heavy Atoms | 26 |
| Complexity | 877.80927 |
Chemical Identifiers
| CAS Number | 869075-50-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(=NCCC2=CC(=C(C=C2)OC)OC)N |
Product Overview
N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide (CAS 869075-50-3), with molecular formula C18H23N3O4S and molecular weight 377.14 g/mol. IUPAC: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylphenyl)sulfonylguanidine.
Chemical Property Profile of N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide
Property Insights of N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide
The XLogP value of 1.84792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide. The TPSA of 103.01 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide 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 N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide?
The CAS number of N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide is 869075-50-3.
What is the molecular formula of N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide is C18H23N3O4S.
What is the molecular weight of N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide is 377.14 g/mol.
Where can I buy N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(N-(3,4-dimethoxyphenethyl)carbamimidoyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.