3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-
TL;DR: 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- (CAS 108651-13-4) is a chemical compound with molecular formula C12H12N2O2 and molecular weight 216.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methyl-N-(2-methylphenyl)-1,2-oxazole-3-carboxamide
Also Known As: 5-methyl-N-(2-methylphenyl)-1,2-oxazole-3-carboxamide, 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-, 5-Methyl-N-(2-methylphenyl)-3-isoxazolecarboxamide, 4-27-00-03998 (Beilstein Handbook Reference), 5-methyl-isoxazole-3-carboxylic acid o-toluidide
Technical Specifications
| Molecular Formula | C12H12N2O2 |
| Molecular Weight | 216.08987 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 216.08987 Da |
| Heavy Atoms | 16 |
| Complexity | 257.0 |
| SMILES | CC1=CC=CC=C1NC(=O)C2=NOC(=C2)C |
| InChIKey | VVORRSQVJKITJQ-UHFFFAOYSA-N |
Chemical Property Profile of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-
Property Insights of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-. With a topological polar surface area (TPSA) of 55.1 Ų, 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- 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
What is the CAS number of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-?
The CAS number of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- is 108651-13-4.
What is the molecular formula of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-?
The molecular formula of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- is C12H12N2O2.
What is the molecular weight of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-?
The molecular weight of 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- is 216.08987 g/mol.
Where can I buy 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-?
You can request a quote for 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)-?
Yes, CoreyChem provides custom synthesis services for 3-Isoxazolecarboxamide, 5-methyl-N-(2-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.