TL;DR: Acridinium, 10-butyl-3,6-diamino-, sulfate (CAS 101952-50-5) is a chemical compound with molecular formula C17H21N3O4S and molecular weight 363.12527 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
10-butylacridin-10-ium-3,6-diamine;hydrogen sulfate
Also Known As: N-Butylproflavine, 10-Butyl-3,6-diaminoacridinium sulfate, ACRIDINIUM, 10-BUTYL-3,6-DIAMINO-, SULFATE, 3,6-diamino-10-butylacridinium hydrogen sulfate, 10-butylacridin-10-ium-3,6-diamine; hydrogen sulfate
| Molecular Formula | C17H21N3O4S |
| Molecular Weight | 363.12527 g/mol |
| XLogP | 2.25 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.12527 Da |
| Heavy Atoms | 25 |
| Complexity | 369.0 |
| SMILES | CCCC[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N.OS(=O)(=O)[O-] |
| InChIKey | QXOUHSJVVLQBMA-UHFFFAOYSA-N |
The XLogP value of 2.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acridinium, 10-butyl-3,6-diamino-, sulfate. The TPSA of 142.0 Ų indicates high polarity, suggesting Acridinium, 10-butyl-3,6-diamino-, sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acridinium, 10-butyl-3,6-diamino-, sulfate has 3 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 Acridinium, 10-butyl-3,6-diamino-, sulfate is 101952-50-5.
The molecular formula of Acridinium, 10-butyl-3,6-diamino-, sulfate is C17H21N3O4S.
The molecular weight of Acridinium, 10-butyl-3,6-diamino-, sulfate is 363.12527 g/mol.
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