TL;DR: 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride (CAS 1049721-17-6) is a chemical compound with molecular formula C15H18ClN5S and molecular weight 335.09714 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-methyltetrazol-5-yl)sulfanyl-N-(naphthalen-1-ylmethyl)ethanamine;hydrochloride
Also Known As: 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride, 2-(1-methyltetrazol-5-yl)sulfanyl-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride
| Molecular Formula | C15H18ClN5S |
| Molecular Weight | 335.09714 g/mol |
| XLogP | 2.667 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.09714 Da |
| Heavy Atoms | 22 |
| Complexity | 316.0 |
| SMILES | CN1C(=NN=N1)SCCNCC2=CC=CC3=CC=CC=C32.Cl |
| InChIKey | MIOXIZOVZXOVKA-UHFFFAOYSA-N |
The XLogP value of 2.667 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride. Following Lipinski's Rule of Five, 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride 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 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride is 1049721-17-6.
The molecular formula of 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride is C15H18ClN5S.
The molecular weight of 2-((1-methyl-1H-tetrazol-5-yl)thio)-N-(naphthalen-1-ylmethyl)ethanamine hydrochloride is 335.09714 g/mol.
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