Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate
TL;DR: Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate (CAS 17185-17-0) is a chemical compound with molecular formula C23H29NO5S and molecular weight 431.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methanesulfonic acid;1-oxido-1-[2-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyloxy)ethyl]pyrrolidin-1-ium
Also Known As: Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate, 9,10-Dihydro-9-(2-(1-pyrrolidinyl)ethoxy)-9,10-ethanoanthracene N-oxide methanesulfonate, 9,10-Ethanoanthracene, 9,10-dihydro-9-(2-(1-pyrrolidinyl)ethoxy)-, N-oxide, methanesulfonate, N-Oxyde de (pyrrolidino-2 ethoxy)-9 dihydro-9,10 ethano-9,10 anthracene et methane-sulfonate, Methanesulfonic acid--1-{2-[(9,10-ethanoanthracen-9(10H)-yl)oxy]ethyl}-1-oxo-1lambda~5~-pyrrolidine (1/1)
| Molecular Formula | C23H29NO5S |
|---|---|
| Molecular Weight | 431.18 g/mol |
| LogP | 3.7983 |
| Topological Polar Surface Area | 90.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.17664 |
| Heavy Atoms | 30 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 17185-17-0 |
|---|---|
| SMILES | CS(=O)(=O)O.C1CC[N+](C1)(CCOC23CCC(C4=CC=CC=C42)C5=CC=CC=C35)[O-] |
| InChIKey | YLVPAXHPQYQIBE-UHFFFAOYSA-N |
Product Overview
Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate (CAS 17185-17-0), with molecular formula C23H29NO5S and molecular weight 431.18 g/mol. IUPAC: methanesulfonic acid;1-oxido-1-[2-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyloxy)ethyl]pyrrolidin-1-ium.
Chemical Property Profile of Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate
Property Insights of Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate
The XLogP value of 3.7983 indicates that Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate. Following Lipinski's Rule of Five, Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate has 1 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 Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate?
The CAS number of Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate is 17185-17-0.
What is the molecular formula of Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate?
The molecular formula of Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate is C23H29NO5S.
What is the molecular weight of Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate?
The molecular weight of Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate is 431.18 g/mol.
Where can I buy Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate?
You can request a quote for Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-(2-(9,10-ethanoanthracen-9(10H)-yloxy)ethyl)-, N-oxide, methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.