(E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide
TL;DR: (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide (CAS 796877-00-4) is a chemical compound with molecular formula C20H18N6O3S2 and molecular weight 454.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[(E)-2-cyano-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl]amino]phenyl]sulfonylguanidine
Also Known As: (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide, 2-[4-[[(E)-2-cyano-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl]amino]phenyl]sulfonylguanidine, N-carbamimidoyl-4-({(E)-2-cyano-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide
| Molecular Formula | C20H18N6O3S2 |
|---|---|
| Molecular Weight | 454.09 g/mol |
| LogP | 2.75738 |
| Topological Polar Surface Area | 156.48 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 454.0882 |
| Heavy Atoms | 31 |
| Complexity | 1267.6995 |
Chemical Identifiers
| CAS Number | 796877-00-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CSC(=N2)/C(=C/NC3=CC=C(C=C3)S(=O)(=O)N=C(N)N)/C#N |
Product Overview
(E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide (CAS 796877-00-4), with molecular formula C20H18N6O3S2 and molecular weight 454.09 g/mol. IUPAC: 2-[4-[[(E)-2-cyano-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]ethenyl]amino]phenyl]sulfonylguanidine.
Chemical Property Profile of (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide
Property Insights of (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide
The XLogP value of 2.75738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide. The TPSA of 156.48 Ų indicates high polarity, suggesting (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide has 3 hydrogen bond donor(s) and 7 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 (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide?
The CAS number of (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide is 796877-00-4.
What is the molecular formula of (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide?
The molecular formula of (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide is C20H18N6O3S2.
What is the molecular weight of (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide?
The molecular weight of (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide is 454.09 g/mol.
Where can I buy (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide?
You can request a quote for (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-carbamimidoyl-4-((2-cyano-2-(4-(4-methoxyphenyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.