TL;DR: Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)- (CAS 130403-11-1) is a chemical compound with molecular formula C13H14N2O2 and molecular weight 230.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)benzamide
Also Known As: Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)-, 2,6-Dimethyl-N-(3-methyl-5-isoxazolyl)benzamide, 2,6-dimethyl-N-(3-methyl-1,2-oxazol-5-yl)benzamide, 2,6-Dimethyl-N-(3-methylisoxazol-5-yl)benzamide, BRN 5817233
| Molecular Formula | C13H14N2O2 |
| Molecular Weight | 230.10553 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.10553 Da |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
| SMILES | CC1=C(C(=CC=C1)C)C(=O)NC2=CC(=NO2)C |
| InChIKey | OBVJNABVWKZHLJ-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)-. With a topological polar surface area (TPSA) of 55.1 Ų, Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)- is 130403-11-1.
The molecular formula of Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)- is C13H14N2O2.
The molecular weight of Benzamide, 2,6-dimethyl-N-(3-methyl-5-isoxazolyl)- is 230.10553 g/mol.
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