TL;DR: N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine (CAS 18991-15-6) is a chemical compound with molecular formula C14H20N4O and molecular weight 260.1637 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N',N'-diethyl-N-(3-phenyl-1,2,4-oxadiazol-5-yl)ethane-1,2-diamine
Also Known As: N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine, N',N'-diethyl-N-(3-phenyl-1,2,4-oxadiazol-5-yl)ethane-1,2-diamine, 5-Diethylamino-ethylamino-3-phenyl-1,2,4-oxadiazol, 5-(2-(Diethylamino)ethylamino)-3-phenyl-1,2,4-oxadiazole, N,N-diethyl-N/'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine
| Molecular Formula | C14H20N4O |
| Molecular Weight | 260.1637 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 54.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 260.1637 Da |
| Heavy Atoms | 19 |
| Complexity | 242.0 |
| SMILES | CCN(CC)CCNC1=NC(=NO1)C2=CC=CC=C2 |
| InChIKey | HFXOMPIWXDVHSZ-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine. With a topological polar surface area (TPSA) of 54.2 Ų, N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine 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 N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine is 18991-15-6.
The molecular formula of N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine is C14H20N4O.
The molecular weight of N,N-Diethyl-N'-(3-phenyl-1,2,4-oxadiazol-5-yl)ethylenediamine is 260.1637 g/mol.
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