TL;DR: 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)- (CAS 126199-02-8) is a chemical compound with molecular formula C10H13N5O4 and molecular weight 267.09674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R,4R)-2-(6-aminopurin-9-yl)-3,4-bis(hydroxymethyl)oxetan-3-ol
Also Known As: 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)-, 9-(2-Hydroxymethyl-beta-D-threo-oxetanosyl)adenosine, (2R,3R,4R)-2-(6-aminopurin-9-yl)-3,4-bis(hydroxymethyl)oxetan-3-ol, 9-(2-Hydroxymethyl-.beta.-D-threo-oxetanosyl)adenosine, (2R,3R,4R)-2-(6-Amino-9H-purin-9-yl)-3,4-bis(hydroxymethyl)oxetan-3-ol
| Molecular Formula | C10H13N5O4 |
| Molecular Weight | 267.09674 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.09674 Da |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@]([C@H](O3)CO)(CO)O)N |
| InChIKey | MCPYANYIZXDZFD-UAINPKIQSA-N |
The XLogP value of -1.9 indicates that 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)- has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)- is 126199-02-8.
The molecular formula of 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)- is C10H13N5O4.
The molecular weight of 2,3-Oxetanedimethanol, 4-(6-amino-9H-purin-9-yl)-3-hydroxy-, (2R,3R,4R)- is 267.09674 g/mol.
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