Doretinel
TL;DR: Doretinel (CAS 104561-36-6) is a chemical compound with molecular formula C24H30O2 and molecular weight 350.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(E)-1-[4-(hydroxymethyl)phenyl]prop-1-en-2-yl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalen-2-ol
Also Known As: DORETINEL, Doretinelum, Doretinel [USAN:INN], Doretinelum [INN-Latin], DORETINEL [INN]
| Molecular Formula | C24H30O2 |
|---|---|
| Molecular Weight | 350.22 g/mol |
| LogP | 5.0592 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.22458 |
| Heavy Atoms | 26 |
| Complexity | 825.7892 |
Chemical Identifiers
| CAS Number | 104561-36-6 |
|---|---|
| SMILES | C/C(=C\C1=CC=C(C=C1)CO)/C2=CC3=C(C=C2)C(CC(C3(C)C)O)(C)C |
Product Overview
Doretinel (CAS 104561-36-6), with molecular formula C24H30O2 and molecular weight 350.22 g/mol. IUPAC: 7-[(E)-1-[4-(hydroxymethyl)phenyl]prop-1-en-2-yl]-1,1,4,4-tetramethyl-2,3-dihydronaphthalen-2-ol.
Chemical Property Profile of Doretinel
Property Insights of Doretinel
The XLogP value of 5.0592 indicates that Doretinel is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, Doretinel exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Doretinel has 2 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 Doretinel?
The CAS number of Doretinel is 104561-36-6.
What is the molecular formula of Doretinel?
The molecular formula of Doretinel is C24H30O2.
What is the molecular weight of Doretinel?
The molecular weight of Doretinel is 350.22 g/mol.
Where can I buy Doretinel?
You can request a quote for Doretinel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Doretinel?
Yes, KEHONG BIO provides custom synthesis services for Doretinel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.