1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol
TL;DR: 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol (CAS 339276-91-4) is a chemical compound with molecular formula C17H20O3S and molecular weight 304.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzylsulfonyl-2-(4-methylphenyl)propan-2-ol
Also Known As: 1-(benzylsulfonyl)-2-(4-methylphenyl)-2-propanol, 2-(4-methylphenyl)-1-phenylmethanesulfonylpropan-2-ol, 1-benzylsulfonyl-2-(4-methylphenyl)propan-2-ol, 1-benzylsulfonyl-2-(p-tolyl)propan-2-ol, 2-(4-Methylphenyl)-1-(phenylmethanesulfonyl)propan-2-ol
| Molecular Formula | C17H20O3S |
|---|---|
| Molecular Weight | 304.11 g/mol |
| LogP | 2.81752 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 304.1133 |
| Heavy Atoms | 21 |
| Complexity | 686.5749 |
Chemical Identifiers
| CAS Number | 339276-91-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C)(CS(=O)(=O)CC2=CC=CC=C2)O |
Product Overview
1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol (CAS 339276-91-4), with molecular formula C17H20O3S and molecular weight 304.11 g/mol. IUPAC: 1-benzylsulfonyl-2-(4-methylphenyl)propan-2-ol.
Chemical Property Profile of 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol
Property Insights of 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol
The XLogP value of 2.81752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol. With a topological polar surface area (TPSA) of 54.37 Ų, 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol 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 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol?
The CAS number of 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol is 339276-91-4.
What is the molecular formula of 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol?
The molecular formula of 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol is C17H20O3S.
What is the molecular weight of 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol?
The molecular weight of 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol is 304.11 g/mol.
Where can I buy 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol?
You can request a quote for 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylsulfonyl)-2-(4-methylphenyl)-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.