4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-
TL;DR: 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- (CAS 72445-42-2) is a chemical compound with molecular formula C15H24S and molecular weight 236.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,5S,6S,7R)-2-methyl-8-methylidene-5-propan-2-yl-11-thiatricyclo[5.3.1.02,6]undecane
Also Known As: 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-, 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene- 1-(1-methylethyl)-, [1S-(1?,3a?,4? ,8?,8a?)]-, 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, [1S-(1.alpha.,3a.alpha.,4.alpha.,8.alpha.,8a.alpha.)]-
| Molecular Formula | C15H24S |
|---|---|
| Molecular Weight | 236.16 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.15987 |
| Heavy Atoms | 16 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 72445-42-2 |
|---|---|
| SMILES | CC(C)[C@@H]1CC[C@@]2([C@H]1[C@@H]3C(=C)CC[C@@H]2S3)C |
| InChIKey | HVLGGQYBXOJMLO-RMEBNNNOSA-N |
Product Overview
4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- (CAS 72445-42-2), with molecular formula C15H24S and molecular weight 236.16 g/mol. IUPAC: (1S,2R,5S,6S,7R)-2-methyl-8-methylidene-5-propan-2-yl-11-thiatricyclo[5.3.1.02,6]undecane.
Chemical Property Profile of 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-
Property Insights of 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-
The XLogP value of 4.6 indicates that 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- has 0 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 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-?
The CAS number of 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- is 72445-42-2.
What is the molecular formula of 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-?
The molecular formula of 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- is C15H24S.
What is the molecular weight of 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-?
The molecular weight of 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- is 236.16 g/mol.
Where can I buy 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-?
You can request a quote for 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))-?
Yes, KEHONG BIO provides custom synthesis services for 4,8-Epithioazulene, decahydro-3a-methyl-7-methylene-1-(1-methylethyl)-, (1S-(1alpha,3aalpha,4alpha,8alpha,8aalpha))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.