TL;DR: (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol (CAS 349108-45-8) is a chemical compound with molecular formula C5H12N2O3 and molecular weight 148.0848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4S,5R)-3-(hydroxymethyl)diazinane-4,5-diol
Also Known As: 1-Azagalactofagomine, AZA-GALACTO-FAGOMINE, (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol, J1.524.802E, (3R,4S,5R)-3-(Hydroxymethyl)hexahydropyridazine-4,5-diol
| Molecular Formula | C5H12N2O3 |
| Molecular Weight | 148.0848 g/mol |
| XLogP | -2.0 |
| Topological Polar Surface Area (TPSA) | 84.8 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 148.0848 Da |
| Heavy Atoms | 10 |
| Complexity | 111.0 |
| SMILES | C1[C@H]([C@H]([C@H](NN1)CO)O)O |
| InChIKey | PPPMSBCQTLJPKM-WDCZJNDASA-N |
The XLogP value of -2.0 indicates that (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol. Following Lipinski's Rule of Five, (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol 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 (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol is 349108-45-8.
The molecular formula of (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol is C5H12N2O3.
The molecular weight of (3r,4s,5r)-3-(Hydroxymethyl)-1,2-Diazinane-4,5-Diol is 148.0848 g/mol.
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