TL;DR: RefChem:95742 (CAS 55850-01-6) is a chemical compound with molecular formula C19H22ClN3 and molecular weight 327.15024 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-methyl-N-[(1,3,3-trimethylindol-1-ium-2-yl)methylideneamino]aniline chloride
Also Known As: 1,3,3-trimethyl-2-[methyl]-3h-indoliumchloride, 1,3,3-Trimethyl-2-((methylphenylhydrazono)methyl)-3H-indolium chloride, 3H-Indolium, 1,3,3-trimethyl-2-((methylphenylhydrazono)methyl)-, chloride, 3H-Indolium, 1,3,3-trimethyl-2-((2-methyl-2-phenylhydrazinylidene)methyl)-, chloride (1:1), Ammonium, methylphenyl(((1,3,3-trimethylindolin-2-ylidene)methyl)imido)-, chloride
| Molecular Formula | C19H22ClN3 |
| Molecular Weight | 327.15024 g/mol |
| XLogP | 0.82 |
| Topological Polar Surface Area (TPSA) | 18.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.15024 Da |
| Heavy Atoms | 23 |
| Complexity | 457.0 |
| SMILES | CC1(C2=CC=CC=C2[N+](=C1C=NN(C)C3=CC=CC=C3)C)C.[Cl-] |
| InChIKey | LBIIFZVMMKQPOY-UHFFFAOYSA-M |
The XLogP value of 0.82 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:95742. With a topological polar surface area (TPSA) of 18.6 Ų, RefChem:95742 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:95742 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 RefChem:95742 is 55850-01-6.
The molecular formula of RefChem:95742 is C19H22ClN3.
The molecular weight of RefChem:95742 is 327.15024 g/mol.
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