TL;DR: n-[(2,6-Dimethylphenyl)carbamothioyl]benzamide (CAS 151221-92-0) is a chemical compound with molecular formula C16H16N2OS and molecular weight 284.09833 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2,6-dimethylphenyl)carbamothioyl]benzamide
Also Known As: n-[(2,6-dimethylphenyl)carbamothioyl]benzamide, 1-(2,6-dimethylphenyl)-3-benzoylthiourea, Benzamide,N-[[(2,6-dimethylphenyl)amino]thioxomethyl]-, BIM-0041228.P001, N-((2,6-dimethylphenyl)carbamothioyl)benzamide
| Molecular Formula | C16H16N2OS |
| Molecular Weight | 284.09833 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 73.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.09833 Da |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
| SMILES | CC1=C(C(=CC=C1)C)NC(=S)NC(=O)C2=CC=CC=C2 |
| InChIKey | BQODTXRRZVSKDI-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that n-[(2,6-Dimethylphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for n-[(2,6-Dimethylphenyl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, n-[(2,6-Dimethylphenyl)carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of n-[(2,6-Dimethylphenyl)carbamothioyl]benzamide is 151221-92-0.
The molecular formula of n-[(2,6-Dimethylphenyl)carbamothioyl]benzamide is C16H16N2OS.
The molecular weight of n-[(2,6-Dimethylphenyl)carbamothioyl]benzamide is 284.09833 g/mol.
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