TL;DR: 4-[5-(1-Adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine (CAS 405279-11-0) is a chemical compound with molecular formula C14H17N5O2 and molecular weight 287.1382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[5-(1-adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
Also Known As: 4-[5-(1-adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine, 4-(5-Tricyclo[3.3.1.13,7]dec-1-yl-1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine, 4-(5-adamantanyl-1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazole-3-ylamine, 4-[5-(ADAMANTAN-1-YL)-1,2,4-OXADIAZOL-3-YL]-1,2,5-OXADIAZOL-3-AMINE, 4-[5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine
| Molecular Formula | C14H17N5O2 |
| Molecular Weight | 287.1382 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.1382 Da |
| Heavy Atoms | 21 |
| Complexity | 392.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=NC(=NO4)C5=NON=C5N |
| InChIKey | UZLRBAYSDWUWGZ-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[5-(1-Adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[5-(1-Adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine. Following Lipinski's Rule of Five, 4-[5-(1-Adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[5-(1-Adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine is 405279-11-0.
The molecular formula of 4-[5-(1-Adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine is C14H17N5O2.
The molecular weight of 4-[5-(1-Adamantyl)-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-amine is 287.1382 g/mol.
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