TL;DR: N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide (CAS 1198072-91-1) is a chemical compound with molecular formula C17H19NO4S and molecular weight 333.1035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethenesulfonamide
Also Known As: (E)-N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethenesulfonamide, N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide
| Molecular Formula | C17H19NO4S |
| Molecular Weight | 333.1035 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 73.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 333.1035 Da |
| Heavy Atoms | 23 |
| Complexity | 465.0 |
| SMILES | COC1=C(C=C(C=C1)CNS(=O)(=O)/C=C/C2=CC=CC=C2)OC |
| InChIKey | JYJJXXJLLOFYHF-ZHACJKMWSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide. The TPSA of 73.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide. Following Lipinski's Rule of Five, N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide is 1198072-91-1.
The molecular formula of N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide is C17H19NO4S.
The molecular weight of N-[(3,4-dimethoxyphenyl)methyl]-2-phenylethene-1-sulfonamide is 333.1035 g/mol.
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