![[(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate structure](/static/products/7506/750602-92-7.webp)
[(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate
TL;DR: [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate (CAS 750602-92-7) is a chemical compound with molecular formula C23H19N3O7S and molecular weight 481.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3-nitroanilino)-2-oxoethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate
Also Known As: [(3-nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate|[2-(3-nitroanilino)-2-oxoethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate|EN300-26599660
| Molecular Formula | C23H19N3O7S |
|---|---|
| Molecular Weight | 481.09 g/mol |
| LogP | 3.8029 |
| Topological Polar Surface Area | 144.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 481.09436 |
| Heavy Atoms | 34 |
| Complexity | 1339.4344 |
Chemical Identifiers
| CAS Number | 750602-92-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/S(=O)(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
[(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate (CAS 750602-92-7), with molecular formula C23H19N3O7S and molecular weight 481.09 g/mol. IUPAC: [2-(3-nitroanilino)-2-oxoethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate.
Chemical Property Profile of [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate
Property Insights of [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate
The XLogP value of 3.8029 indicates that [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.71 Ų indicates high polarity, suggesting [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate has 2 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 [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
The CAS number of [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is 750602-92-7.
What is the molecular formula of [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
The molecular formula of [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is C23H19N3O7S.
What is the molecular weight of [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
The molecular weight of [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is 481.09 g/mol.
Where can I buy [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
You can request a quote for [(3-Nitrophenyl)carbamoyl]methyl 3-(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 [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for [(3-Nitrophenyl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.