![2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE structure](/static/products/3104/310418-22-5.webp)
2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE
TL;DR: 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE (CAS 310418-22-5) is a chemical compound with molecular formula C20H18N6O6S5 and molecular weight 597.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-cyano-3-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-sulfamoylphenyl)acetamide
Also Known As: 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE, 2-((3-((2-(4-(Aminosulfonyl)anilino)-2-oxoethyl)sulfanyl)-4-cyano-5-isothiazolyl)sulfanyl)-N-(4-(aminosulfonyl)phenyl)acetamide, 2-[[4-cyano-3-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-sulfamoylphenyl)acetamide, 2-{[4-CYANO-3-({[(4-SULFAMOYLPHENYL)CARBAMOYL]METHYL}SULFANYL)-1,2-THIAZOL-5-YL]SULFANYL}-N-(4-SULFAMOYLPHENYL)ACETAMIDE, 648-930-1
| Molecular Formula | C20H18N6O6S5 |
|---|---|
| Molecular Weight | 597.99 g/mol |
| LogP | 1.77118 |
| Topological Polar Surface Area | 215.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 597.98914 |
| Heavy Atoms | 37 |
| Complexity | 1452.0525 |
Chemical Identifiers
| CAS Number | 310418-22-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CSC2=C(C(=NS2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N)C#N)S(=O)(=O)N |
Product Overview
2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE (CAS 310418-22-5), with molecular formula C20H18N6O6S5 and molecular weight 597.99 g/mol. IUPAC: 2-[[4-cyano-3-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-sulfamoylphenyl)acetamide.
Chemical Property Profile of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE
Property Insights of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE
The XLogP value of 1.77118 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE. The TPSA of 215.2 Ų indicates high polarity, suggesting 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE?
The CAS number of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE is 310418-22-5.
What is the molecular formula of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE?
The molecular formula of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE is C20H18N6O6S5.
What is the molecular weight of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE?
The molecular weight of 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE is 597.99 g/mol.
Where can I buy 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE?
You can request a quote for 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE?
Yes, KEHONG BIO provides custom synthesis services for 2-{[3-({2-[4-(AMINOSULFONYL)ANILINO]-2-OXOETHYL}SULFANYL)-4-CYANO-5-ISOTHIAZOLYL]SULFANYL}-N-[4-(AMINOSULFONYL)PHENYL]ACETAMIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.