脱氧蝇蕈碱
TL;DR: 脱氧蝇蕈碱 (CAS 99665-31-3) is a chemical compound with molecular formula C10H22NO+ and molecular weight 172.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
脱氧蝇蕈碱
[(1R,3S,4S)-3-hydroxy-4-methylcyclopentyl]methyl-trimethylazanium
Also Known As: Desethermuscarine, KST-1A7230, J1.435.988E, [(1R,3S,4S)-3-hydroxy-4-methylcyclopentyl]methyl-trimethylazanium, Cyclopentanemethanaminium, 3-hydroxy-N,N,N,4-tetramethyl-
| Molecular Formula | C10H22NO+ |
|---|---|
| Molecular Weight | 172.17 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.17014 |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 99665-31-3 |
|---|---|
| SMILES | C[C@H]1C[C@H](C[C@@H]1O)C[N+](C)(C)C |
| InChIKey | GZOFMJXUNQQSJT-AEJSXWLSSA-N |
Product Overview
脱氧蝇蕈碱 (CAS 99665-31-3), with molecular formula C10H22NO+ and molecular weight 172.17 g/mol. IUPAC: [(1R,3S,4S)-3-hydroxy-4-methylcyclopentyl]methyl-trimethylazanium.
Chemical Property Profile of 脱氧蝇蕈碱
Property Insights of 脱氧蝇蕈碱
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 脱氧蝇蕈碱. With a topological polar surface area (TPSA) of 20.2 Ų, 脱氧蝇蕈碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 脱氧蝇蕈碱 has 1 hydrogen bond donor(s) and 1 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 脱氧蝇蕈碱?
The CAS number of 脱氧蝇蕈碱 is 99665-31-3.
What is the molecular formula of 脱氧蝇蕈碱?
The molecular formula of 脱氧蝇蕈碱 is C10H22NO+.
What is the molecular weight of 脱氧蝇蕈碱?
The molecular weight of 脱氧蝇蕈碱 is 172.17 g/mol.
Where can I buy 脱氧蝇蕈碱?
You can request a quote for 脱氧蝇蕈碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 脱氧蝇蕈碱?
Yes, KEHONG BIO provides custom synthesis services for 脱氧蝇蕈碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.