Neosarranicine
TL;DR: Neosarranicine (CAS 136173-27-8) is a chemical compound with molecular formula C18H27NO5 and molecular weight 337.18893 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[7-[(E)-2-methylbut-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-2-(hydroxymethyl)but-2-enoate
Also Known As: Neosarranicine, Neosarracine, Sarranicine, Sarracine, [7-[(E)-2-methylbut-2-enoyl]oxy-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (E)-2-(hydroxymethyl)but-2-enoate
Technical Specifications
| Molecular Formula | C18H27NO5 |
| Molecular Weight | 337.18893 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 337.18893 Da |
| Heavy Atoms | 24 |
| Complexity | 540.0 |
| SMILES | C/C=C(\C)/C(=O)OC1CCN2C1C(CC2)COC(=O)/C(=C/C)/CO |
| InChIKey | YMUQRQKYYOWGPN-QGVJZHQLSA-N |
Chemical Property Profile of Neosarranicine
Property Insights of Neosarranicine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Neosarranicine. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Neosarranicine. Following Lipinski's Rule of Five, Neosarranicine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Neosarranicine?
The CAS number of Neosarranicine is 136173-27-8.
What is the molecular formula of Neosarranicine?
The molecular formula of Neosarranicine is C18H27NO5.
What is the molecular weight of Neosarranicine?
The molecular weight of Neosarranicine is 337.18893 g/mol.
Where can I buy Neosarranicine?
You can request a quote for Neosarranicine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Neosarranicine?
Yes, CoreyChem provides custom synthesis services for Neosarranicine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.