TL;DR: 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride (CAS 22199-93-5) is a chemical compound with molecular formula C10H12ClN5O2S and molecular weight 301.04 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(2-aminopyrimidin-4-yl)amino]benzenesulfonamide;hydrochloride
Also Known As: 4-[(2-aminopyrimidin-4-yl)amino]benzene-1-sulfonamide hydrochloride, 4-((2-Aminopyrimidin-4-yl)amino)benzenesulfonamide hydrochloride, 4-[(2-aminopyrimidin-4-yl)amino]benzenesulfonamide;hydrochloride, 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide, hydrochloride, 4-(2-AMINO-4-PYRIMIDYLAMINO)BENZENESULFONAMIDE HYDROCHLORIDE
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H12ClN5O2S |
| Molecular Weight | 301.04 g/mol |
| XLogP | 0.87 |
| Topological Polar Surface Area (TPSA) | 132.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.04 Da |
| Heavy Atoms | 19 |
| Complexity | 361.0 |
| SMILES | C1=CC(=CC=C1NC2=NC(=NC=C2)N)S(=O)(=O)N.Cl |
| InChIKey | AJQQWYVKGSZKFW-UHFFFAOYSA-N |
The XLogP value of 0.87 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride. Following Lipinski's Rule of Five, 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride is 22199-93-5.
The molecular formula of 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride is C10H12ClN5O2S.
The molecular weight of 4-(2-Amino-4-pyrimidylamino)benzenesulfonamide hydrochloride is 301.04 g/mol.
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