5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-
TL;DR: 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- (CAS 130403-05-3) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-dimethylphenyl)-3-methyl-1,2-oxazole-5-carboxamide
Also Known As: 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-, N-(2,6-Dimethylphenyl)-3-methyl-5-isoxazolecarboxamide, N-(2,6-Dimethylphenyl)-3-methylisoxazole-5-carboxamide, N-(2,6-dimethylphenyl)-3-methyl-1,2-oxazole-5-carboxamide, 3-Methyl-N-(2,6-dimethylphenyl)isoxazole-5-carboxamide
| Molecular Formula | C13H14N2O2 |
|---|---|
| Molecular Weight | 230.11 g/mol |
| LogP | 2.85216 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.10553 |
| Heavy Atoms | 17 |
| Complexity | 538.0471 |
Chemical Identifiers
| CAS Number | 130403-05-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=NO2)C |
Product Overview
5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- (CAS 130403-05-3), with molecular formula C13H14N2O2 and molecular weight 230.11 g/mol. IUPAC: N-(2,6-dimethylphenyl)-3-methyl-1,2-oxazole-5-carboxamide.
Chemical Property Profile of 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-
Property Insights of 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-
The XLogP value of 2.85216 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-. With a topological polar surface area (TPSA) of 55.13 Ų, 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- 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 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-?
The CAS number of 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- is 130403-05-3.
What is the molecular formula of 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-?
The molecular formula of 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- is C13H14N2O2.
What is the molecular weight of 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-?
The molecular weight of 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- is 230.11 g/mol.
Where can I buy 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-?
You can request a quote for 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.