TL;DR: m-Anisidine, 4-((5-(methylthio)pentyl)oxy)- (CAS 106270-88-6) is a chemical compound with molecular formula C13H21NO2S and molecular weight 255.1293 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methoxy-4-(5-methylsulfanylpentoxy)aniline
Also Known As: 3-methoxy-4-(5-methylsulfanylpentoxy)aniline, M & B 5524, 4-((5-(Methylthio)pentyl)oxy)-m-anisidine, m-ANISIDINE, 4-((5-(METHYLTHIO)PENTYL)OXY)-, 3-methoxy-4-{[5-(methylsulfanyl)pentyl]oxy}aniline
| Molecular Formula | C13H21NO2S |
| Molecular Weight | 255.1293 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 69.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 255.1293 Da |
| Heavy Atoms | 17 |
| Complexity | 192.0 |
| SMILES | COC1=C(C=CC(=C1)N)OCCCCCSC |
| InChIKey | DBEKNFDHJQPQEI-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for m-Anisidine, 4-((5-(methylthio)pentyl)oxy)-. The TPSA of 69.8 Ų falls within the moderate polarity range, balancing permeability and solubility for m-Anisidine, 4-((5-(methylthio)pentyl)oxy)-. Following Lipinski's Rule of Five, m-Anisidine, 4-((5-(methylthio)pentyl)oxy)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of m-Anisidine, 4-((5-(methylthio)pentyl)oxy)- is 106270-88-6.
The molecular formula of m-Anisidine, 4-((5-(methylthio)pentyl)oxy)- is C13H21NO2S.
The molecular weight of m-Anisidine, 4-((5-(methylthio)pentyl)oxy)- is 255.1293 g/mol.
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