![2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate structure](/static/products/7902/790248-74-7.webp)
2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate
TL;DR: 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate (CAS 790248-74-7) is a chemical compound with molecular formula C22H25N3O6S and molecular weight 459.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate
Also Known As: AB00728444-01, [2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate, 2-[(tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate
| Molecular Formula | C22H25N3O6S |
|---|---|
| Molecular Weight | 459.15 g/mol |
| LogP | 2.8803 |
| Topological Polar Surface Area | 130.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 459.1464 |
| Heavy Atoms | 32 |
| Complexity | 1088.7361 |
Chemical Identifiers
| CAS Number | 790248-74-7 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)/C=C/C2=CC=CC=C2 |
Product Overview
2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate (CAS 790248-74-7), with molecular formula C22H25N3O6S and molecular weight 459.15 g/mol. IUPAC: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 4-[[(E)-2-phenylethenyl]sulfonylamino]benzoate.
Chemical Property Profile of 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate
Property Insights of 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate
The XLogP value of 2.8803 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate. The TPSA of 130.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate. Following Lipinski's Rule of Five, 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate has 3 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-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate?
The CAS number of 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate is 790248-74-7.
What is the molecular formula of 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate?
The molecular formula of 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate is C22H25N3O6S.
What is the molecular weight of 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate?
The molecular weight of 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate is 459.15 g/mol.
Where can I buy 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate?
You can request a quote for 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Tert-butylcarbamoyl)amino]-2-oxoethyl 4-(2-phenylethenesulfonamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.