萨拉辛N-氧化物
TL;DR: 萨拉辛N-氧化物 (CAS 19038-27-8) is a chemical compound with molecular formula C18H27NO6 and molecular weight 353.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
萨拉辛N-氧化物
[7-(2-methylbut-2-enoyloxy)-4-oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-(hydroxymethyl)but-2-enoate
Also Known As: SARRACINE N-OXIDE, [7-(2-methylbut-2-enoyloxy)-4-oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-(hydroxymethyl)but-2-enoate, {7-[(2-methylbut-2-enoyl)oxy]-4-oxidohexahydro-1H-pyrrolizin-1-yl}methyl 2-(hydroxymethyl)but-2-enoate
| Molecular Formula | C18H27NO6 |
|---|---|
| Molecular Weight | 353.18 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 353.18384 |
| Heavy Atoms | 25 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 19038-27-8 |
|---|---|
| SMILES | CC=C(C)C(=O)OC1CC[N+]2(C1C(CC2)COC(=O)C(=CC)CO)[O-] |
| InChIKey | MUIDVKVQYZTVRF-UHFFFAOYSA-N |
Product Overview
萨拉辛N-氧化物 (CAS 19038-27-8), with molecular formula C18H27NO6 and molecular weight 353.18 g/mol. IUPAC: [7-(2-methylbut-2-enoyloxy)-4-oxido-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-4-ium-1-yl]methyl 2-(hydroxymethyl)but-2-enoate.
Chemical Property Profile of 萨拉辛N-氧化物
Property Insights of 萨拉辛N-氧化物
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 萨拉辛N-氧化物. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 萨拉辛N-氧化物. Following Lipinski's Rule of Five, 萨拉辛N-氧化物 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
Frequently Asked Questions
What is the CAS number of 萨拉辛N-氧化物?
The CAS number of 萨拉辛N-氧化物 is 19038-27-8.
What is the molecular formula of 萨拉辛N-氧化物?
The molecular formula of 萨拉辛N-氧化物 is C18H27NO6.
What is the molecular weight of 萨拉辛N-氧化物?
The molecular weight of 萨拉辛N-氧化物 is 353.18 g/mol.
Where can I buy 萨拉辛N-氧化物?
You can request a quote for 萨拉辛N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 萨拉辛N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 萨拉辛N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.