N-十二烷基单氮杂-15-冠-5-N-氧化物
TL;DR: N-十二烷基单氮杂-15-冠-5-N-氧化物 (CAS 129117-50-6) is a chemical compound with molecular formula C22H45NO5 and molecular weight 403.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-十二烷基单氮杂-15-冠-5-N-氧化物
13-dodecyl-13-oxido-1,4,7,10-tetraoxa-13-azoniacyclopentadecane
Also Known As: Dma-15-cno, N-Dodecylmonoaza-15-crown-5-N-oxide, 13-Dodecyl-1,4,7,10-tetraoxa-13-azacyclopentadecane 13-oxide, 13-dodecyl-13-oxido-1,4,7,10-tetraoxa-13-azoniacyclopentadecane, 1,4,7,10-Tetraoxa-13-azacyclopentadecane, 13-dodecyl-, 13-oxide
| Molecular Formula | C22H45NO5 |
|---|---|
| Molecular Weight | 403.33 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 403.32977 |
| Heavy Atoms | 28 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 129117-50-6 |
|---|---|
| SMILES | CCCCCCCCCCCC[N+]1(CCOCCOCCOCCOCC1)[O-] |
| InChIKey | BNHTVBBNSUAPFY-UHFFFAOYSA-N |
Product Overview
N-十二烷基单氮杂-15-冠-5-N-氧化物 (CAS 129117-50-6), with molecular formula C22H45NO5 and molecular weight 403.33 g/mol. IUPAC: 13-dodecyl-13-oxido-1,4,7,10-tetraoxa-13-azoniacyclopentadecane.
Chemical Property Profile of N-十二烷基单氮杂-15-冠-5-N-氧化物
Property Insights of N-十二烷基单氮杂-15-冠-5-N-氧化物
The XLogP value of 4.5 indicates that N-十二烷基单氮杂-15-冠-5-N-氧化物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.0 Ų, N-十二烷基单氮杂-15-冠-5-N-氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-十二烷基单氮杂-15-冠-5-N-氧化物 has 0 hydrogen bond donor(s) and 5 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 N-十二烷基单氮杂-15-冠-5-N-氧化物?
The CAS number of N-十二烷基单氮杂-15-冠-5-N-氧化物 is 129117-50-6.
What is the molecular formula of N-十二烷基单氮杂-15-冠-5-N-氧化物?
The molecular formula of N-十二烷基单氮杂-15-冠-5-N-氧化物 is C22H45NO5.
What is the molecular weight of N-十二烷基单氮杂-15-冠-5-N-氧化物?
The molecular weight of N-十二烷基单氮杂-15-冠-5-N-氧化物 is 403.33 g/mol.
Where can I buy N-十二烷基单氮杂-15-冠-5-N-氧化物?
You can request a quote for N-十二烷基单氮杂-15-冠-5-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 N-十二烷基单氮杂-15-冠-5-N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for N-十二烷基单氮杂-15-冠-5-N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.