TL;DR: 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one (CAS 114149-42-7) is a chemical compound with molecular formula C20H21N3O4S and molecular weight 399.12527 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methoxy-N-[5-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide
Also Known As: 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one, Benzenesulfonamide, N-(2,3-dihydro-5-(1,4,5,6-tetrahydro-6-oxo-3-pyridazinyl)-1H-inden-2-yl)-4-methoxy-, (+-)-, A-[(, A-Amino-isovalerylamino)-acetamino]-isovaleriansaeure
| Molecular Formula | C20H21N3O4S |
| Molecular Weight | 399.12527 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.12527 Da |
| Heavy Atoms | 28 |
| Complexity | 709.0 |
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)NC2CC3=C(C2)C=C(C=C3)C4=NNC(=O)CC4 |
| InChIKey | BSXFYFMTUPKQIQ-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one. Following Lipinski's Rule of Five, 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one is 114149-42-7.
The molecular formula of 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one is C20H21N3O4S.
The molecular weight of 6-(2-o-Methoxybenzenesulphonamido-indan-5-yl)-4,5-dihydro-pyridazin-3(2H)-one is 399.12527 g/mol.
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