Petasitene
TL;DR: Petasitene (CAS 443124-67-2) is a chemical compound with molecular formula C15H24 and molecular weight 204.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,6R,7S)-2,6-dimethyl-3-propan-2-yltricyclo[5.2.1.02,6]dec-3-ene
Also Known As: Petasitene, J2.381.275D, (1R,2S,6R,7S)-2,6-dimethyl-3-propan-2-yltricyclo[5.2.1.02,6]dec-3-ene, (1R,2S,6R,7S)-2,6-dimethyl-3-(propan-2-yl)tricyclo[5.2.1.02,6]dec-3-ene, (1R,2S,6R,7S)-2,6-dimethyl-3-propan-2-yltricyclo(5.2.1.02,6)dec-3-ene
| Molecular Formula | C15H24 |
|---|---|
| Molecular Weight | 204.19 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.1878 |
| Heavy Atoms | 15 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 443124-67-2 |
|---|---|
| SMILES | CC(C)C1=CC[C@]2([C@@]1([C@@H]3CC[C@H]2C3)C)C |
| InChIKey | ZGKPBXWQOYDEMA-CTHBEMJXSA-N |
Product Overview
Petasitene (CAS 443124-67-2), with molecular formula C15H24 and molecular weight 204.19 g/mol. IUPAC: (1R,2S,6R,7S)-2,6-dimethyl-3-propan-2-yltricyclo[5.2.1.02,6]dec-3-ene.
Chemical Property Profile of Petasitene
Property Insights of Petasitene
The XLogP value of 4.7 indicates that Petasitene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Petasitene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Petasitene has 0 hydrogen bond donor(s) and 0 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 Petasitene?
The CAS number of Petasitene is 443124-67-2.
What is the molecular formula of Petasitene?
The molecular formula of Petasitene is C15H24.
What is the molecular weight of Petasitene?
The molecular weight of Petasitene is 204.19 g/mol.
Where can I buy Petasitene?
You can request a quote for Petasitene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Petasitene?
Yes, KEHONG BIO provides custom synthesis services for Petasitene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.