3-苯基-1,2,4-恶二唑-5-胺
TL;DR: 3-苯基-1,2,4-恶二唑-5-胺 (CAS 3663-37-4) is a chemical compound with molecular formula C8H7N3O and molecular weight 161.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-苯基-1,2,4-恶二唑-5-胺
3-phenyl-1,2,4-oxadiazol-5-amine
Also Known As: 3-Phenyl-1,2,4-oxadiazol-5-amine, 5-Amino-3-phenyl-1,2,4-oxadiazole, 1,2,4-Oxadiazol-5-amine, 3-phenyl-, DZHVJUCGKWKRTO-UHFFFAOYSA-, 1,2,4-Oxadiazol-5-amine,3-phenyl-
| Molecular Formula | C8H7N3O |
|---|---|
| Molecular Weight | 161.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.05891 |
| Heavy Atoms | 12 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 3663-37-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NOC(=N2)N |
| InChIKey | DZHVJUCGKWKRTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-苯基-1,2,4-恶二唑-5-胺 (CAS 3663-37-4), with molecular formula C8H7N3O and molecular weight 161.06 g/mol. IUPAC: 3-phenyl-1,2,4-oxadiazol-5-amine.
Chemical Property Profile of 3-苯基-1,2,4-恶二唑-5-胺
Property Insights of 3-苯基-1,2,4-恶二唑-5-胺
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-苯基-1,2,4-恶二唑-5-胺. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-苯基-1,2,4-恶二唑-5-胺. Following Lipinski's Rule of Five, 3-苯基-1,2,4-恶二唑-5-胺 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 3-苯基-1,2,4-恶二唑-5-胺?
The CAS number of 3-苯基-1,2,4-恶二唑-5-胺 is 3663-37-4.
What is the molecular formula of 3-苯基-1,2,4-恶二唑-5-胺?
The molecular formula of 3-苯基-1,2,4-恶二唑-5-胺 is C8H7N3O.
What is the molecular weight of 3-苯基-1,2,4-恶二唑-5-胺?
The molecular weight of 3-苯基-1,2,4-恶二唑-5-胺 is 161.06 g/mol.
Where can I buy 3-苯基-1,2,4-恶二唑-5-胺?
You can request a quote for 3-苯基-1,2,4-恶二唑-5-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-苯基-1,2,4-恶二唑-5-胺?
Yes, KEHONG BIO provides custom synthesis services for 3-苯基-1,2,4-恶二唑-5-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.