TL;DR: 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)- (CAS 111254-05-8) is a chemical compound with molecular formula C25H41N3O2 and molecular weight 415.3199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[1-(3-pentadecylphenoxy)ethyl]-1,3,4-oxadiazol-2-amine
Also Known As: 5-(1-Phenoxyethyl)-1,3,4-oxadiazol-2-amine, 5-(1-(3-Pentadecylphenoxy)ethyl)-1,3,4-oxadiazol-2-amine, 5-[1-(3-pentadecylphenoxy)ethyl]-1,3,4-oxadiazol-2-amine, 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)-, 2-Amino-5-alpha-(3'-pentadecylphenoxyethyl)-1,3,4-oxadiazole
| Molecular Formula | C25H41N3O2 |
| Molecular Weight | 415.3199 g/mol |
| XLogP | 9.1 |
| Topological Polar Surface Area (TPSA) | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 17 |
| Exact Mass | 415.3199 Da |
| Heavy Atoms | 30 |
| Complexity | 410.0 |
| SMILES | CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(C)C2=NN=C(O2)N |
| InChIKey | FTJJMWCOBVPYBQ-UHFFFAOYSA-N |
The XLogP value of 9.1 indicates that 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)-. Following Lipinski's Rule of Five, 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)- is 111254-05-8.
The molecular formula of 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)- is C25H41N3O2.
The molecular weight of 1,3,4-Oxadiazol-2-amine, 5-(1-(3-pentadecylphenoxy)ethyl)- is 415.3199 g/mol.
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