(Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide
TL;DR: (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide (CAS 797799-68-9) is a chemical compound with molecular formula C20H15N5O5S2 and molecular weight 469.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]phenyl]sulfonylurea
Also Known As: (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide, [4-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]phenyl]sulfonylurea, 4-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-N-carbamoylbenzenesulfonamide
| Molecular Formula | C20H15N5O5S2 |
|---|---|
| Molecular Weight | 469.05 g/mol |
| LogP | 2.87238 |
| Topological Polar Surface Area | 156.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 469.05145 |
| Heavy Atoms | 32 |
| Complexity | 1357.7625 |
Chemical Identifiers
| CAS Number | 797799-68-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)/C(=C\NC4=CC=C(C=C4)S(=O)(=O)NC(=O)N)/C#N |
Product Overview
(Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide (CAS 797799-68-9), with molecular formula C20H15N5O5S2 and molecular weight 469.05 g/mol. IUPAC: [4-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]phenyl]sulfonylurea.
Chemical Property Profile of (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide
Property Insights of (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide
The XLogP value of 2.87238 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide. The TPSA of 156.43 Ų indicates high polarity, suggesting (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide has 3 hydrogen bond donor(s) and 9 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 (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide?
The CAS number of (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide is 797799-68-9.
What is the molecular formula of (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide?
The molecular formula of (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide is C20H15N5O5S2.
What is the molecular weight of (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide?
The molecular weight of (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide is 469.05 g/mol.
Where can I buy (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide?
You can request a quote for (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-N-carbamoylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.