TL;DR: 4-acetyl-N-[3-(dimethylamino)propyl]benzene-1-sulfonamide (CAS 1003494-10-7) is a chemical compound with molecular formula C13H20N2O3S and molecular weight 284.11948 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-acetyl-N-[3-(dimethylamino)propyl]benzenesulfonamide
Also Known As: 4-acetyl-N-[3-(dimethylamino)propyl]benzene-1-sulfonamide, 4-acetyl-N-[3-(dimethylamino)propyl]benzenesulfonamide, N-[3-(dimethylamino)propyl]-4-acetylbenzene-1-sulfonamide, 4-acetyl-N-(3-dimethylaminopropyl)benzenesulfonamide, C13H20N2O3S
| Molecular Formula | C13H20N2O3S |
| Molecular Weight | 284.11948 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 284.11948 Da |
| Heavy Atoms | 19 |
| Complexity | 379.0 |
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCCN(C)C |
| InChIKey | MZQIJPSRNXMUMZ-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-acetyl-N-[3-(dimethylamino)propyl]benzene-1-sulfonamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-acetyl-N-[3-(dimethylamino)propyl]benzene-1-sulfonamide. Following Lipinski's Rule of Five, 4-acetyl-N-[3-(dimethylamino)propyl]benzene-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 4-acetyl-N-[3-(dimethylamino)propyl]benzene-1-sulfonamide is 1003494-10-7.
The molecular formula of 4-acetyl-N-[3-(dimethylamino)propyl]benzene-1-sulfonamide is C13H20N2O3S.
The molecular weight of 4-acetyl-N-[3-(dimethylamino)propyl]benzene-1-sulfonamide is 284.11948 g/mol.
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