rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol
TL;DR: rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol (CAS 1484-91-9) is a chemical compound with molecular formula C20H24O3 and molecular weight 312.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(2R,6S)-6-(4-methoxyphenyl)oxan-2-yl]ethyl]phenol
Also Known As: Centrolobine, Centrolobin, (-)-Centrolobine, 4-[2-[(2R,6S)-6-(4-methoxyphenyl)oxan-2-yl]ethyl]phenol, J1.732.863H
| Molecular Formula | C20H24O3 |
|---|---|
| Molecular Weight | 312.17 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.17255 |
| Heavy Atoms | 23 |
| Complexity | 330.0 |
Chemical Identifiers
| CAS Number | 1484-91-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)[C@@H]2CCC[C@@H](O2)CCC3=CC=C(C=C3)O |
| InChIKey | VKLGDLFSGNHXAV-UXHICEINSA-N |
Product Overview
rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol (CAS 1484-91-9), with molecular formula C20H24O3 and molecular weight 312.17 g/mol. IUPAC: 4-[2-[(2R,6S)-6-(4-methoxyphenyl)oxan-2-yl]ethyl]phenol.
Chemical Property Profile of rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol
Property Insights of rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol
The XLogP value of 4.4 indicates that rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol has 1 hydrogen bond donor(s) and 3 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 rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol?
The CAS number of rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol is 1484-91-9.
What is the molecular formula of rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol?
The molecular formula of rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol is C20H24O3.
What is the molecular weight of rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol?
The molecular weight of rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol is 312.17 g/mol.
Where can I buy rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol?
You can request a quote for rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for rel-4-(2-((2R,6S)-Tetrahydro-6-(4-methoxyphenyl)-2H-pyran-2-yl)ethyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.