TL;DR: N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide (CAS 1005164-09-9) is a chemical compound with molecular formula C23H28N2O3S and molecular weight 412.18207 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide
Also Known As: N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide, N-(bicyclo[2.2.1]hept-2-yl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide, N-bicyclo[2.2.1]hept-2-yl-3-{[(2,3-dimethylphenyl)amino]sulfonyl}-4-methylbenzamide
| Molecular Formula | C23H28N2O3S |
| Molecular Weight | 412.18207 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 83.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.18207 Da |
| Heavy Atoms | 29 |
| Complexity | 703.0 |
| SMILES | CC1=C(C(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3CC4CCC3C4)C)C |
| InChIKey | UFOJLSDFJAEVNE-UHFFFAOYSA-N |
The XLogP value of 4.6 indicates that N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide. Following Lipinski's Rule of Five, N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide is 1005164-09-9.
The molecular formula of N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide is C23H28N2O3S.
The molecular weight of N-(3-bicyclo[2.2.1]heptanyl)-3-[(2,3-dimethylphenyl)sulfamoyl]-4-methylbenzamide is 412.18207 g/mol.
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