Bicarbamimide, 2-hexyl-3-phenyl-
TL;DR: Bicarbamimide, 2-hexyl-3-phenyl- (CAS 101116-81-8) is a chemical compound with molecular formula C14H19N3O2 and molecular weight 261.14774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-hexyl-2-phenyl-1,2,4-triazolidine-3,5-dione
Also Known As: 2-Hexyl-3-phenylbicarbamimide, Bicarbamimide, 2-hexyl-3-phenyl-, UR 94, 1-hexyl-2-phenyl-1,2,4-triazolidine-3,5-dione, 1,2,4-Triazolidine-3,5-dione, 1-hexyl-2-phenyl-
Technical Specifications
| Molecular Formula | C14H19N3O2 |
| Molecular Weight | 261.14774 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 261.14774 Da |
| Heavy Atoms | 19 |
| Complexity | 327.0 |
| SMILES | CCCCCCN1C(=O)NC(=O)N1C2=CC=CC=C2 |
| InChIKey | SMJUUWGWPHPKAJ-UHFFFAOYSA-N |
Chemical Property Profile of Bicarbamimide, 2-hexyl-3-phenyl-
Property Insights of Bicarbamimide, 2-hexyl-3-phenyl-
The XLogP value of 3.2 indicates that Bicarbamimide, 2-hexyl-3-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.7 Ų, Bicarbamimide, 2-hexyl-3-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicarbamimide, 2-hexyl-3-phenyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Bicarbamimide, 2-hexyl-3-phenyl-?
The CAS number of Bicarbamimide, 2-hexyl-3-phenyl- is 101116-81-8.
What is the molecular formula of Bicarbamimide, 2-hexyl-3-phenyl-?
The molecular formula of Bicarbamimide, 2-hexyl-3-phenyl- is C14H19N3O2.
What is the molecular weight of Bicarbamimide, 2-hexyl-3-phenyl-?
The molecular weight of Bicarbamimide, 2-hexyl-3-phenyl- is 261.14774 g/mol.
Where can I buy Bicarbamimide, 2-hexyl-3-phenyl-?
You can request a quote for Bicarbamimide, 2-hexyl-3-phenyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bicarbamimide, 2-hexyl-3-phenyl-?
Yes, CoreyChem provides custom synthesis services for Bicarbamimide, 2-hexyl-3-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.