![3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol structure](/static/products/7920/79201-85-7.webp)
3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol
TL;DR: 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol (CAS 79201-85-7) is a chemical compound with molecular formula C16H25NO and molecular weight 247.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol
Also Known As: PICENADOL, Picenadol [INN], Picenadolum [INN-Latin], Lilly 150720, LY 97435
| Molecular Formula | C16H25NO |
|---|---|
| Molecular Weight | 247.19 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.19362 |
| Heavy Atoms | 18 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 79201-85-7 |
|---|---|
| SMILES | CCC[C@@]1(CCN(C[C@@H]1C)C)C2=CC(=CC=C2)O |
| InChIKey | RTOHPIRUUAKHOZ-BBRMVZONSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol (CAS 79201-85-7), with molecular formula C16H25NO and molecular weight 247.19 g/mol. IUPAC: 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol.
Chemical Property Profile of 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol
Property Insights of 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol
The XLogP value of 4.2 indicates that 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol has 1 hydrogen bond donor(s) and 2 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 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol?
The CAS number of 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol is 79201-85-7.
What is the molecular formula of 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol?
The molecular formula of 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol is C16H25NO.
What is the molecular weight of 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol?
The molecular weight of 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol is 247.19 g/mol.
Where can I buy 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol?
You can request a quote for 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3R,4S)-1,3-dimethyl-4-propylpiperidin-4-yl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.