TL;DR: 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)- (CAS 114915-73-0) is a chemical compound with molecular formula C12H13N3O and molecular weight 215.10587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(methylamino)-2,4,4a,5-tetrahydroindeno[1,2-c]pyridazin-3-one
Also Known As: 7-Methylamino-4,4a-dihydro-5H-indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-Tetrahydro-7-(methylamino)-3H-indeno(1,2-c)pyridazin-3-one, 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)-, 7-(methylamino)-2,4,4a,5-tetrahydroindeno[1,2-c]pyridazin-3-one, 7-(Methylamino)-4a,5-dihydro-4H-indeno[1,2-c]pyridazin-3-ol
| Molecular Formula | C12H13N3O |
| Molecular Weight | 215.10587 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 53.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.10587 Da |
| Heavy Atoms | 16 |
| Complexity | 339.0 |
| SMILES | CNC1=CC2=C(C=C1)C3=NNC(=O)CC3C2 |
| InChIKey | HAHPYOKDQDCPLI-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)-. With a topological polar surface area (TPSA) of 53.5 Ų, 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)- has 2 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 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)- is 114915-73-0.
The molecular formula of 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)- is C12H13N3O.
The molecular weight of 3H-Indeno(1,2-c)pyridazin-3-one, 2,4,4a,5-tetrahydro-7-(methylamino)- is 215.10587 g/mol.
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