TL;DR: 4,5-Dichloro-4,5-dihydronaphtho[1,2-c][1,2,5]thiadiazole (CAS 120614-09-7) is a chemical compound with molecular formula C10H6Cl2N2S and molecular weight 255.96288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5-dichloro-4,5-dihydrobenzo[e][2,1,3]benzothiadiazole
Also Known As: 4,5-dichloro-4,5-dihydronaphtho[1,2-c][1,2,5]thiadiazole, 4,5-dichloro-4,5-dihydrobenzo[e][2,1,3]benzothiadiazole, 4,5-dichloro-4,5-dihydrobenzo[g][2,1,3]benzothiadiazole, 4,5-dichloro-4H,5H-naphtho[1,2-c][1,2,5]thiadiazole, Naphtho[1,2-c][1,2,5]thiadiazole, 4,5-dichloro-4,5-dihydro-
| Molecular Formula | C10H6Cl2N2S |
| Molecular Weight | 255.96288 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 255.96288 Da |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
| SMILES | C1=CC=C2C(=C1)C(C(C3=NSN=C23)Cl)Cl |
| InChIKey | ZVJIRFQMSBONAD-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dichloro-4,5-dihydronaphtho[1,2-c][1,2,5]thiadiazole. With a topological polar surface area (TPSA) of 54.0 Ų, 4,5-Dichloro-4,5-dihydronaphtho[1,2-c][1,2,5]thiadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dichloro-4,5-dihydronaphtho[1,2-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 4,5-Dichloro-4,5-dihydronaphtho[1,2-c][1,2,5]thiadiazole is 120614-09-7.
The molecular formula of 4,5-Dichloro-4,5-dihydronaphtho[1,2-c][1,2,5]thiadiazole is C10H6Cl2N2S.
The molecular weight of 4,5-Dichloro-4,5-dihydronaphtho[1,2-c][1,2,5]thiadiazole is 255.96288 g/mol.
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