Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
TL;DR: Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone (CAS 898137-23-0) is a chemical compound with molecular formula C14H22N2O2 and molecular weight 250.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
Also Known As: Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone, azaperhydroocinyl 3-ethyl-5-methylisoxazol-4-yl ketone, 1-AZOCANYL(3-ETHYL-5-METHYL-4-ISOXAZOLYL)METHANONE, azocan-1-yl(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
| Molecular Formula | C14H22N2O2 |
|---|---|
| Molecular Weight | 250.17 g/mol |
| LogP | 2.95172 |
| Topological Polar Surface Area | 46.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.16812 |
| Heavy Atoms | 18 |
| Complexity | 403.92654 |
Chemical Identifiers
| CAS Number | 898137-23-0 |
|---|---|
| SMILES | CCC1=NOC(=C1C(=O)N2CCCCCCC2)C |
Product Overview
Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone (CAS 898137-23-0), with molecular formula C14H22N2O2 and molecular weight 250.17 g/mol. IUPAC: azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone.
Chemical Property Profile of Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
Property Insights of Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone
The XLogP value of 2.95172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone. With a topological polar surface area (TPSA) of 46.34 Ų, Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone has 0 hydrogen bond donor(s) and 3 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 Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
The CAS number of Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone is 898137-23-0.
What is the molecular formula of Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
The molecular formula of Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone is C14H22N2O2.
What is the molecular weight of Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
The molecular weight of Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone is 250.17 g/mol.
Where can I buy Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
You can request a quote for Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for Azocan-1-yl-(3-ethyl-5-methyl-1,2-oxazol-4-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.