TL;DR: 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine (CAS 1596362-29-6) is a chemical compound with molecular formula C12H15N3OS and molecular weight 249.09358 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-ethylsulfanyl-1,3,4-oxadiazol-2-yl)-2-phenylethanamine
Also Known As: PS372424 hydrochloride, 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine, BAS 00278261, BAS 13158966, 1-(5-(Ethylthio)-1,3,4-oxadiazol-2-yl)-2-phenylethanamine
| Molecular Formula | C12H15N3OS |
| Molecular Weight | 249.09358 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 90.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.09358 Da |
| Heavy Atoms | 17 |
| Complexity | 224.0 |
| SMILES | CCSC1=NN=C(O1)C(CC2=CC=CC=C2)N |
| InChIKey | XFKKBHQXKGVWHM-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine. The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine. Following Lipinski's Rule of Five, 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine has 1 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 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine is 1596362-29-6.
The molecular formula of 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine is C12H15N3OS.
The molecular weight of 1-(5-Ethylsulfanyl-[1,3,4]oxadiazol-2-yl)-2-phenyl-ethylamine is 249.09358 g/mol.
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