TL;DR: 2-(2-Dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone (CAS 117027-28-8) is a chemical compound with molecular formula C16H21N3O and molecular weight 271.16846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-benzylidene-2-[2-(dimethylamino)ethyl]-6-methylpyridazin-3-one
Also Known As: DBMP, 2-(2-Dimethylaminoethyl)-5-benzylidene-6-methyl-3-pyridazinone, 3(2H)-Pyridazinone,2-[2-(dimethylamino)ethyl]-4,5-dihydro-6-methyl-5-(phenylmethylene)-, 2-(2-dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone
| Molecular Formula | C16H21N3O |
| Molecular Weight | 271.16846 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.16846 Da |
| Heavy Atoms | 20 |
| Complexity | 406.0 |
| SMILES | CC1=NN(C(=O)CC1=CC2=CC=CC=C2)CCN(C)C |
| InChIKey | MJLRNZWUIWIHKX-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone. With a topological polar surface area (TPSA) of 35.9 Ų, 2-(2-Dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone 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 2-(2-Dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone is 117027-28-8.
The molecular formula of 2-(2-Dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone is C16H21N3O.
The molecular weight of 2-(2-Dimethylaminoethyl)5-benzylidene-6-methyl-(2h,4h)-3-pyridazinone is 271.16846 g/mol.
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