d-Centrolobine
TL;DR: d-Centrolobine (CAS 30359-02-5) 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-[6-(4-methoxyphenyl)oxan-2-yl]ethyl]phenol
Also Known As: d-Centrolobine, Centrolobin, C(Cc1ccc(O)cc1)C2CCCC(O2)c3ccc(OC)cc3, 4-[2-[6-(4-methoxyphenyl)oxan-2-yl]ethyl]phenol, 4-{2-[6-(4-METHOXYPHENYL)OXAN-2-YL]ETHYL}PHENOL
| 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 | 30359-02-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2CCCC(O2)CCC3=CC=C(C=C3)O |
| InChIKey | VKLGDLFSGNHXAV-UHFFFAOYSA-N |
Product Overview
d-Centrolobine (CAS 30359-02-5), with molecular formula C20H24O3 and molecular weight 312.17 g/mol. IUPAC: 4-[2-[6-(4-methoxyphenyl)oxan-2-yl]ethyl]phenol.
Chemical Property Profile of d-Centrolobine
Property Insights of d-Centrolobine
The XLogP value of 4.4 indicates that d-Centrolobine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, d-Centrolobine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, d-Centrolobine 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 d-Centrolobine?
The CAS number of d-Centrolobine is 30359-02-5.
What is the molecular formula of d-Centrolobine?
The molecular formula of d-Centrolobine is C20H24O3.
What is the molecular weight of d-Centrolobine?
The molecular weight of d-Centrolobine is 312.17 g/mol.
Where can I buy d-Centrolobine?
You can request a quote for d-Centrolobine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for d-Centrolobine?
Yes, KEHONG BIO provides custom synthesis services for d-Centrolobine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.