TL;DR: 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole (CAS 15777-28-3) is a chemical compound with molecular formula C7H5ClN2S and molecular weight 183.98619 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-4-methyl-2,1,3-benzothiadiazole
Also Known As: 5-chloro-4-methyl-2,1,3-benzothiadiazole, 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole, 5-chloro-4-methylbenzo-2,1,3-thiadiazole
| Molecular Formula | C7H5ClN2S |
| Molecular Weight | 183.98619 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.98619 Da |
| Heavy Atoms | 11 |
| Complexity | 155.0 |
| SMILES | CC1=C(C=CC2=NSN=C12)Cl |
| InChIKey | HZPAPCAIDLEWIE-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole. With a topological polar surface area (TPSA) of 54.0 Ų, 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole has 0 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 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole is 15777-28-3.
The molecular formula of 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole is C7H5ClN2S.
The molecular weight of 5-Chloro-4-methylbenzo[c][1,2,5]thiadiazole is 183.98619 g/mol.
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