鱼腥藻毒素酸异恶唑烷
TL;DR: 鱼腥藻毒素酸异恶唑烷 (CAS 125736-29-0) is a chemical compound with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
鱼腥藻毒素酸异恶唑烷
[(1R)-9-azabicyclo[4.2.1]non-2-en-2-yl]-(1,2-oxazolidin-2-yl)methanone
Also Known As: Anatoxinic acid isoxazolidide, [(6R)-9-azabicyclo[4.2.1]non-4-en-5-yl]-(1,2-oxazolidin-2-yl)methanone
| Molecular Formula | C12H18N2O2 |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.13683 |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 125736-29-0 |
|---|---|
| SMILES | C1CN(OC1)C(=O)C2=CCCC3CC[C@H]2N3 |
| InChIKey | QQTHPDUOEJYQFG-HCCKASOXSA-N |
Product Overview
鱼腥藻毒素酸异恶唑烷 (CAS 125736-29-0), with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol. IUPAC: [(1R)-9-azabicyclo[4.2.1]non-2-en-2-yl]-(1,2-oxazolidin-2-yl)methanone.
Chemical Property Profile of 鱼腥藻毒素酸异恶唑烷
Property Insights of 鱼腥藻毒素酸异恶唑烷
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 鱼腥藻毒素酸异恶唑烷. With a topological polar surface area (TPSA) of 41.6 Ų, 鱼腥藻毒素酸异恶唑烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 鱼腥藻毒素酸异恶唑烷 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
Frequently Asked Questions
What is the CAS number of 鱼腥藻毒素酸异恶唑烷?
The CAS number of 鱼腥藻毒素酸异恶唑烷 is 125736-29-0.
What is the molecular formula of 鱼腥藻毒素酸异恶唑烷?
The molecular formula of 鱼腥藻毒素酸异恶唑烷 is C12H18N2O2.
What is the molecular weight of 鱼腥藻毒素酸异恶唑烷?
The molecular weight of 鱼腥藻毒素酸异恶唑烷 is 222.14 g/mol.
Where can I buy 鱼腥藻毒素酸异恶唑烷?
You can request a quote for 鱼腥藻毒素酸异恶唑烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 鱼腥藻毒素酸异恶唑烷?
Yes, KEHONG BIO provides custom synthesis services for 鱼腥藻毒素酸异恶唑烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.