Sevitropiummesilat
TL;DR: Sevitropiummesilat (CAS 88199-75-1) is a chemical compound with molecular formula C24H29NO5S2 and molecular weight 475.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,4R)-7-(6,11-dihydrobenzo[c][1]benzothiepin-11-yloxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane;methanesulfonate
Also Known As: Sevitropium mesilate, Sevitropiummesilat, Sevitropium mesilate [INN]
| Molecular Formula | C24H29NO5S2 |
|---|---|
| Molecular Weight | 475.15 g/mol |
| LogP | 3.3167 |
| Topological Polar Surface Area | 78.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 475.1487 |
| Heavy Atoms | 32 |
| Complexity | 1043.3776 |
Chemical Identifiers
| CAS Number | 88199-75-1 |
|---|---|
| SMILES | C[N+]1(C2CC(CC1[C@@H]3[C@H]2O3)OC4C5=CC=CC=C5CSC6=CC=CC=C46)C.CS(=O)(=O)[O-] |
Product Overview
Sevitropiummesilat (CAS 88199-75-1), with molecular formula C24H29NO5S2 and molecular weight 475.15 g/mol. IUPAC: (2S,4R)-7-(6,11-dihydrobenzo[c][1]benzothiepin-11-yloxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane;methanesulfonate.
Chemical Property Profile of Sevitropiummesilat
Property Insights of Sevitropiummesilat
The XLogP value of 3.3167 indicates that Sevitropiummesilat is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.96 Ų falls within the moderate polarity range, balancing permeability and solubility for Sevitropiummesilat. Following Lipinski's Rule of Five, Sevitropiummesilat has 0 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 Sevitropiummesilat?
The CAS number of Sevitropiummesilat is 88199-75-1.
What is the molecular formula of Sevitropiummesilat?
The molecular formula of Sevitropiummesilat is C24H29NO5S2.
What is the molecular weight of Sevitropiummesilat?
The molecular weight of Sevitropiummesilat is 475.15 g/mol.
Where can I buy Sevitropiummesilat?
You can request a quote for Sevitropiummesilat directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sevitropiummesilat?
Yes, KEHONG BIO provides custom synthesis services for Sevitropiummesilat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.