TL;DR: N-(5-Butoxy-2-pyrimidinyl)-P-toluenesulfonamide (CAS 13418-92-3) is a chemical compound with molecular formula C15H19N3O3S and molecular weight 321.11472 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(5-butoxypyrimidin-2-yl)-4-methylbenzenesulfonamide
Also Known As: N-(5-BUTOXY-2-PYRIMIDINYL)-P-TOLUENESULFONAMIDE, N-(5-butoxypyrimidin-2-yl)-4-methylbenzenesulfonamide, N-(5-butoxypyrimidin-2-yl)-4-methyl-benzenesulfonamide, N-(5-butoxypyrimidin-2-yl)-4-methylbenzene-1-sulfonamide, 651-807-5
| Molecular Formula | C15H19N3O3S |
| Molecular Weight | 321.11472 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 89.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 321.11472 Da |
| Heavy Atoms | 22 |
| Complexity | 408.0 |
| SMILES | CCCCOC1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | VUTLOGVSBZVXPK-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-Butoxy-2-pyrimidinyl)-P-toluenesulfonamide. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-Butoxy-2-pyrimidinyl)-P-toluenesulfonamide. Following Lipinski's Rule of Five, N-(5-Butoxy-2-pyrimidinyl)-P-toluenesulfonamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(5-Butoxy-2-pyrimidinyl)-P-toluenesulfonamide is 13418-92-3.
The molecular formula of N-(5-Butoxy-2-pyrimidinyl)-P-toluenesulfonamide is C15H19N3O3S.
The molecular weight of N-(5-Butoxy-2-pyrimidinyl)-P-toluenesulfonamide is 321.11472 g/mol.
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