TL;DR: 4-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione (CAS 132746-03-3) is a chemical compound with molecular formula C10H7ClN4O2S and molecular weight 281.99783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-6-chloro-2-(4-nitrophenyl)pyridazine-3-thione
Also Known As: ACNPZ, 4-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione, 4-amino-6-chloro-2-(4-nitrophenyl)pyridazine-3-thione, 4-amino-6-chloro-2-(4-nitrophenyl)pyridazine-3(2h)-thione, 3(2H)-Pyridazinethione,4-amino-6-chloro-2-(4-nitrophenyl)-
| Molecular Formula | C10H7ClN4O2S |
| Molecular Weight | 281.99783 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.99783 Da |
| Heavy Atoms | 18 |
| Complexity | 438.0 |
| SMILES | C1=CC(=CC=C1N2C(=S)C(=CC(=N2)Cl)N)[N+](=O)[O-] |
| InChIKey | QZYXGMTWLQODJB-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione. Following Lipinski's Rule of Five, 4-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione has 1 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-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione is 132746-03-3.
The molecular formula of 4-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione is C10H7ClN4O2S.
The molecular weight of 4-Amino-6-chloro-2-(4-nitrophenyl)-3(2H)pyridazinethione is 281.99783 g/mol.
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