TL;DR: 4-(4-Methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide (CAS 141542-12-3) is a chemical compound with molecular formula C9H11N3O3S and molecular weight 241.05211 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-methoxyphenyl)-1,1-dioxo-2,3-dihydro-1,2,5-thiadiazol-4-amine
Also Known As: 4-(4-methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide, 3-(4-methoxyphenyl)-1,1-dioxo-2,3-dihydro-1,2,5-thiadiazol-4-amine, 4-(4-methoxyphenyl)-1,2,5-thiadiazolidin-3-imine 1,1-dioxide, 4-amino-3-(4-methoxyphenyl)-2,3-dihydro-1,2,5-thiadiazole-1,1-dione, 3-imino-4-(4-methoxyphenyl)-1lambda6,2,5-thiadiazolidine-1,1-dione
| Molecular Formula | C9H11N3O3S |
| Molecular Weight | 241.05211 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.05211 Da |
| Heavy Atoms | 16 |
| Complexity | 379.0 |
| SMILES | COC1=CC=C(C=C1)C2C(=NS(=O)(=O)N2)N |
| InChIKey | UOTYWJUVELGPDX-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide. Following Lipinski's Rule of Five, 4-(4-Methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(4-Methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide is 141542-12-3.
The molecular formula of 4-(4-Methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide is C9H11N3O3S.
The molecular weight of 4-(4-Methoxyphenyl)-4,5-dihydro-1,2,5-thiadiazol-3-amine 1,1-dioxide is 241.05211 g/mol.
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