![2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane structure](/static/products/3392/339276-49-2.webp)
2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane
TL;DR: 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane (CAS 339276-49-2) is a chemical compound with molecular formula C17H17NO6S and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(benzenesulfonylmethyl)-4-nitrophenyl]-2-methyl-1,3-dioxolane
Also Known As: Bionet1_002657, 2-{3-[(benzenesulfonyl)methyl]-4-nitrophenyl}-2-methyl-1,3-dioxolane, 2-methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane, 2-Methyl-2-(4-nitro-3-((phenylsulfonyl)methyl)phenyl)-1,3-dioxolane, 2-[3-(benzenesulfonylmethyl)-4-nitrophenyl]-2-methyl-1,3-dioxolane
| Molecular Formula | C17H17NO6S |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | 2.7882 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.07767 |
| Heavy Atoms | 25 |
| Complexity | 888.609 |
Chemical Identifiers
| CAS Number | 339276-49-2 |
|---|---|
| SMILES | CC1(OCCO1)C2=CC(=C(C=C2)[N+](=O)[O-])CS(=O)(=O)C3=CC=CC=C3 |
Product Overview
2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane (CAS 339276-49-2), with molecular formula C17H17NO6S and molecular weight 363.08 g/mol. IUPAC: 2-[3-(benzenesulfonylmethyl)-4-nitrophenyl]-2-methyl-1,3-dioxolane.
Chemical Property Profile of 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane
Property Insights of 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane
The XLogP value of 2.7882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane. Following Lipinski's Rule of Five, 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane has 0 hydrogen bond donor(s) and 6 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-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane?
The CAS number of 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane is 339276-49-2.
What is the molecular formula of 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane?
The molecular formula of 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane is C17H17NO6S.
What is the molecular weight of 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane?
The molecular weight of 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane is 363.08 g/mol.
Where can I buy 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane?
You can request a quote for 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-{4-nitro-3-[(phenylsulfonyl)methyl]phenyl}-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.