5-Undecyl-1,3,4-oxadiazol-2(3H)-imine
TL;DR: 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine (CAS 74655-71-3) is a chemical compound with molecular formula C13H25N3O and molecular weight 239.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-undecyl-1,3,4-oxadiazol-2-amine
Also Known As: 5-undecyl-1,3,4-oxadiazol-2-amine, 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine, 5-Undecyl-1,3,4-oxadiazole-2-amine, 5-undecyl-3H-1,3,4-oxadiazol-2-imine, NCI60_006830
| Molecular Formula | C13H25N3O |
|---|---|
| Molecular Weight | 239.20 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 239.19977 |
| Heavy Atoms | 17 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 74655-71-3 |
|---|---|
| SMILES | CCCCCCCCCCCC1=NN=C(O1)N |
| InChIKey | YEJPDPZLHKSBPB-UHFFFAOYSA-N |
Product Overview
5-Undecyl-1,3,4-oxadiazol-2(3H)-imine (CAS 74655-71-3), with molecular formula C13H25N3O and molecular weight 239.20 g/mol. IUPAC: 5-undecyl-1,3,4-oxadiazol-2-amine.
Chemical Property Profile of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine
Property Insights of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine
The XLogP value of 4.1 indicates that 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine. Following Lipinski's Rule of Five, 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine?
The CAS number of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine is 74655-71-3.
What is the molecular formula of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine?
The molecular formula of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine is C13H25N3O.
What is the molecular weight of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine?
The molecular weight of 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine is 239.20 g/mol.
Where can I buy 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine?
You can request a quote for 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine?
Yes, KEHONG BIO provides custom synthesis services for 5-Undecyl-1,3,4-oxadiazol-2(3H)-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.