Sydnone, 4-isopropyl-3-(p-tolyl)-
TL;DR: Sydnone, 4-isopropyl-3-(p-tolyl)- (CAS 3815-75-6) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)-4-propan-2-yloxadiazol-3-ium-5-olate
Also Known As: Sydnone, 4-isopropyl-3-(p-tolyl)-, 4-Isopropyl-3-(p-tolyl)sydnone, N-(p-Tolyl)-C-(isopropyl)-sydnon, N-(p-Tolyl)-C-(isopropyl)-sydnon [German], 4-Isopropyl-3-(p-methylphenyl)sydnone
| Molecular Formula | C12H14N2O2 |
|---|---|
| Molecular Weight | 218.11 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.10553 |
| Heavy Atoms | 16 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 3815-75-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)[N+]2=NOC(=C2C(C)C)[O-] |
| InChIKey | FZSCJHFWOABLGR-UHFFFAOYSA-N |
Product Overview
Sydnone, 4-isopropyl-3-(p-tolyl)- (CAS 3815-75-6), with molecular formula C12H14N2O2 and molecular weight 218.11 g/mol. IUPAC: 3-(4-methylphenyl)-4-propan-2-yloxadiazol-3-ium-5-olate.
Chemical Property Profile of Sydnone, 4-isopropyl-3-(p-tolyl)-
Property Insights of Sydnone, 4-isopropyl-3-(p-tolyl)-
The XLogP value of 4.3 indicates that Sydnone, 4-isopropyl-3-(p-tolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, Sydnone, 4-isopropyl-3-(p-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sydnone, 4-isopropyl-3-(p-tolyl)- has 0 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 Sydnone, 4-isopropyl-3-(p-tolyl)-?
The CAS number of Sydnone, 4-isopropyl-3-(p-tolyl)- is 3815-75-6.
What is the molecular formula of Sydnone, 4-isopropyl-3-(p-tolyl)-?
The molecular formula of Sydnone, 4-isopropyl-3-(p-tolyl)- is C12H14N2O2.
What is the molecular weight of Sydnone, 4-isopropyl-3-(p-tolyl)-?
The molecular weight of Sydnone, 4-isopropyl-3-(p-tolyl)- is 218.11 g/mol.
Where can I buy Sydnone, 4-isopropyl-3-(p-tolyl)-?
You can request a quote for Sydnone, 4-isopropyl-3-(p-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sydnone, 4-isopropyl-3-(p-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Sydnone, 4-isopropyl-3-(p-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.