TL;DR: [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate (CAS 756837-32-8) is a chemical compound with molecular formula C24H20N2O7S and molecular weight 480.09912 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate
Also Known As: [(1,3-dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate|[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]benzoate|EN300-26609513
| Molecular Formula | C24H20N2O7S |
| Molecular Weight | 480.09912 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 480.09912 Da |
| Heavy Atoms | 34 |
| Complexity | 835.0 |
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)COC(=O)C3=CC(=CC=C3)NS(=O)(=O)/C=C/C4=CC=CC=C4 |
| InChIKey | PNFHHIJGUXLZMK-VAWYXSNFSA-N |
The XLogP value of 3.4 indicates that [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate. Following Lipinski's Rule of Five, [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is 756837-32-8.
The molecular formula of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is C24H20N2O7S.
The molecular weight of [(1,3-Dioxaindan-5-yl)carbamoyl]methyl 3-(2-phenylethenesulfonamido)benzoate is 480.09912 g/mol.
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