TL;DR: starbld0003215 (CAS 1401777-29-4) is a chemical compound with molecular formula C11H16N5O4S+ and molecular weight 314.0923 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-3H-purin-9-ium-6-thione
Also Known As: starbld0003215, 7-Methyl-6-thioguanosine, 2-Amino-9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-7-methyl-6-thioxo-6,9-dihydro-3H-purin-7-ium, 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-3H-purin-9-ium-6-thione, 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-3H-purine-6-thione
| Molecular Formula | C11H16N5O4S+ |
| Molecular Weight | 314.0923 g/mol |
| XLogP | -2.0 |
| Topological Polar Surface Area (TPSA) | 161.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.0923 Da |
| Heavy Atoms | 21 |
| Complexity | 478.0 |
| SMILES | CN1C=[N+](C2=C1C(=S)N=C(N2)N)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O |
| InChIKey | RFHIWBUKNJIBSE-KQYNXXCUSA-O |
The XLogP value of -2.0 indicates that starbld0003215 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting starbld0003215 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, starbld0003215 has 5 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 starbld0003215 is 1401777-29-4.
The molecular formula of starbld0003215 is C11H16N5O4S+.
The molecular weight of starbld0003215 is 314.0923 g/mol.
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