3-Allylfentanyl
TL;DR: 3-Allylfentanyl (CAS 82208-84-2) is a chemical compound with molecular formula C25H32N2O and molecular weight 376.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-N-[(3S,4R)-1-(2-phenylethyl)-3-prop-2-enylpiperidin-4-yl]propanamide
Also Known As: 3-Allylfentanyl, (+/-)-cis-3-Allylfentanyl, cis-(+/-)-3-allylfentanyl, 3-Allylfentanyl, cis-(+/-)-, Propanamide, N-phenyl-N-((3R,4S)-1-(2-phenylethyl)-3-(2-propen-1-yl)-4-piperidinyl)-, rel-
| Molecular Formula | C25H32N2O |
|---|---|
| Molecular Weight | 376.25 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 376.25146 |
| Heavy Atoms | 28 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 82208-84-2 |
|---|---|
| SMILES | CCC(=O)N([C@@H]1CCN(C[C@@H]1CC=C)CCC2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | BZXKQFFMDLTPJL-LADGPHEKSA-N |
Product Overview
3-Allylfentanyl (CAS 82208-84-2), with molecular formula C25H32N2O and molecular weight 376.25 g/mol. IUPAC: N-phenyl-N-[(3S,4R)-1-(2-phenylethyl)-3-prop-2-enylpiperidin-4-yl]propanamide.
Chemical Property Profile of 3-Allylfentanyl
Property Insights of 3-Allylfentanyl
The XLogP value of 5.1 indicates that 3-Allylfentanyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.6 Ų, 3-Allylfentanyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Allylfentanyl has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Allylfentanyl?
The CAS number of 3-Allylfentanyl is 82208-84-2.
What is the molecular formula of 3-Allylfentanyl?
The molecular formula of 3-Allylfentanyl is C25H32N2O.
What is the molecular weight of 3-Allylfentanyl?
The molecular weight of 3-Allylfentanyl is 376.25 g/mol.
Where can I buy 3-Allylfentanyl?
You can request a quote for 3-Allylfentanyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Allylfentanyl?
Yes, KEHONG BIO provides custom synthesis services for 3-Allylfentanyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.