Sumarotene
TL;DR: Sumarotene (CAS 105687-93-2) is a chemical compound with molecular formula C24H30O2S and molecular weight 382.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,4,4-tetramethyl-6-[1-(4-methylsulfonylphenyl)prop-1-en-2-yl]-2,3-dihydronaphthalene
Also Known As: Sumarotene
| Molecular Formula | C24H30O2S |
|---|---|
| Molecular Weight | 382.20 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.19666 |
| Heavy Atoms | 27 |
| Complexity | 657.0 |
Chemical Identifiers
| CAS Number | 105687-93-2 |
|---|---|
| SMILES | CC(=CC1=CC=C(C=C1)S(=O)(=O)C)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C |
| InChIKey | AUCWKKVIBKHRED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sumarotene (CAS 105687-93-2), with molecular formula C24H30O2S and molecular weight 382.20 g/mol. IUPAC: 1,1,4,4-tetramethyl-6-[1-(4-methylsulfonylphenyl)prop-1-en-2-yl]-2,3-dihydronaphthalene.
Chemical Property Profile of Sumarotene
Property Insights of Sumarotene
The XLogP value of 7.2 indicates that Sumarotene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, Sumarotene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sumarotene 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 Sumarotene?
The CAS number of Sumarotene is 105687-93-2.
What is the molecular formula of Sumarotene?
The molecular formula of Sumarotene is C24H30O2S.
What is the molecular weight of Sumarotene?
The molecular weight of Sumarotene is 382.20 g/mol.
Where can I buy Sumarotene?
You can request a quote for Sumarotene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sumarotene?
Yes, KEHONG BIO provides custom synthesis services for Sumarotene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.