TL;DR: MeOAlaNHPO3(Et)AZT (CAS 134250-45-6) is a chemical compound with molecular formula C16H25N6O8P and molecular weight 460.14716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]propanoate
Also Known As: MeOAlaNHPO3(Et)AZT, methyl 3-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-ethoxy-phosphoryl]amino]propanoate, methyl 3-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]propanoate, 3'-Azido-3'-deoxythymidine-5'-(ethyl methoxy-.beta.-alaninyl)phosphoramidate, Thymidine, 3'-azido-3'-deoxy-, 5'-[ethyl (3-methoxy-3-oxopropyl)phosphoramidate], -
| Molecular Formula | C16H25N6O8P |
| Molecular Weight | 460.14716 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 460.14716 Da |
| Heavy Atoms | 31 |
| Complexity | 829.0 |
| SMILES | CCOP(=O)(NCCC(=O)OC)OC[C@@H]1[C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)C)N=[N+]=[N-] |
| InChIKey | KTHYNDKKTKUYBP-OAUZWUJESA-N |
The XLogP value of -0.1 indicates that MeOAlaNHPO3(Et)AZT is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting MeOAlaNHPO3(Et)AZT may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, MeOAlaNHPO3(Et)AZT has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of MeOAlaNHPO3(Et)AZT is 134250-45-6.
The molecular formula of MeOAlaNHPO3(Et)AZT is C16H25N6O8P.
The molecular weight of MeOAlaNHPO3(Et)AZT is 460.14716 g/mol.
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