2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol
TL;DR: 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol (CAS 121086-21-3) is a chemical compound with molecular formula C20H22O5S2 and molecular weight 406.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(benzenesulfonyl)-2-methyl-3-(4-methylphenyl)sulfonylhexa-3,5-dien-2-ol
Also Known As: 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol, 6-(benzenesulfonyl)-2-methyl-3-(4-methylphenyl)sulfonylhexa-3,5-dien-2-ol, 6-(Benzenesulfonyl)-2-methyl-3-(4-methylbenzene-1-sulfonyl)hexa-3,5-dien-2-ol
| Molecular Formula | C20H22O5S2 |
|---|---|
| Molecular Weight | 406.09 g/mol |
| LogP | 3.41112 |
| Topological Polar Surface Area | 88.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.09088 |
| Heavy Atoms | 27 |
| Complexity | 1055.442 |
Chemical Identifiers
| CAS Number | 121086-21-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(=CC=CS(=O)(=O)C2=CC=CC=C2)C(C)(C)O |
Product Overview
2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol (CAS 121086-21-3), with molecular formula C20H22O5S2 and molecular weight 406.09 g/mol. IUPAC: 6-(benzenesulfonyl)-2-methyl-3-(4-methylphenyl)sulfonylhexa-3,5-dien-2-ol.
Chemical Property Profile of 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol
Property Insights of 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol
The XLogP value of 3.41112 indicates that 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol. Following Lipinski's Rule of Five, 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol has 1 hydrogen bond donor(s) and 5 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 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol?
The CAS number of 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol is 121086-21-3.
What is the molecular formula of 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol?
The molecular formula of 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol is C20H22O5S2.
What is the molecular weight of 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol?
The molecular weight of 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol is 406.09 g/mol.
Where can I buy 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol?
You can request a quote for 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-[(4-methylphenyl)sulfonyl]-6-(phenylsulfonyl)-3,5-hexadien-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.