5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium
TL;DR: 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium (CAS 158190-67-1) is a chemical compound with molecular formula C11H14N3O+ and molecular weight 204.1137 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-amine
Also Known As: Feprosidnine, IDI1_019453, 3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-amine, 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium, 5-amino-3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium
Technical Specifications
| Molecular Formula | C11H14N3O+ |
| Molecular Weight | 204.1137 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 55.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.1137 Da |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
| SMILES | CC(CC1=CC=CC=C1)[N+]2=NOC(=C2)N |
| InChIKey | UDUSHLMWUKFPIU-UHFFFAOYSA-N |
Chemical Property Profile of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium
Property Insights of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium. With a topological polar surface area (TPSA) of 55.9 Ų, 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium?
The CAS number of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium is 158190-67-1.
What is the molecular formula of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium?
The molecular formula of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium is C11H14N3O+.
What is the molecular weight of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium?
The molecular weight of 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium is 204.1137 g/mol.
Where can I buy 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium?
You can request a quote for 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium?
Yes, CoreyChem provides custom synthesis services for 5-Amino-3-(1-methyl-2-phenylethyl)-1,2,3-oxadiazolium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.