托扎啉酮
TL;DR: 托扎啉酮 (CAS 655-05-0) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
托扎啉酮
2-(dimethylamino)-5-phenyl-1,3-oxazol-4-one
Also Known As: THOZALINONE, Tozalinone, Stimsen, Tozalinona, Tozalinonum
| Molecular Formula | C11H12N2O2 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.08987 |
| Heavy Atoms | 15 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 655-05-0 |
|---|---|
| SMILES | CN(C)C1=NC(=O)C(O1)C2=CC=CC=C2 |
| InChIKey | JJSHYECKYLDYAR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
托扎啉酮 (CAS 655-05-0), with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol. IUPAC: 2-(dimethylamino)-5-phenyl-1,3-oxazol-4-one.
Chemical Property Profile of 托扎啉酮
Property Insights of 托扎啉酮
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 托扎啉酮. With a topological polar surface area (TPSA) of 41.9 Ų, 托扎啉酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 托扎啉酮 has 0 hydrogen bond donor(s) and 2 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 托扎啉酮?
The CAS number of 托扎啉酮 is 655-05-0.
What is the molecular formula of 托扎啉酮?
The molecular formula of 托扎啉酮 is C11H12N2O2.
What is the molecular weight of 托扎啉酮?
The molecular weight of 托扎啉酮 is 204.09 g/mol.
Where can I buy 托扎啉酮?
You can request a quote for 托扎啉酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 托扎啉酮?
Yes, KEHONG BIO provides custom synthesis services for 托扎啉酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.