TL;DR: N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide (CAS 1309215-46-0) is a chemical compound with molecular formula C17H22N2O2S and molecular weight 318.1402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[4-(dimethylamino)phenyl]methyl]-2,5-dimethylbenzenesulfonamide
Also Known As: N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide, N-[(4-dimethylaminophenyl)methyl]-2,5-dimethylbenzenesulfonamide, N-[[4-(dimethylamino)phenyl]methyl]-2,5-dimethylbenzenesulfonamide, N-{[4-(DIMETHYLAMINO)PHENYL]METHYL}-2,5-DIMETHYLBENZENE-1-SULFONAMIDE
| Molecular Formula | C17H22N2O2S |
| Molecular Weight | 318.1402 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 57.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.1402 Da |
| Heavy Atoms | 22 |
| Complexity | 436.0 |
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)N(C)C |
| InChIKey | GKQAFJQNDOQDOG-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.8 Ų, N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide is 1309215-46-0.
The molecular formula of N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide is C17H22N2O2S.
The molecular weight of N-[4-(dimethylamino)benzyl]-2,5-dimethylbenzenesulfonamide is 318.1402 g/mol.
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