TL;DR: 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride (CAS 134478-63-0) is a chemical compound with molecular formula C14H18ClNOS2 and molecular weight 315.05185 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(3-methoxyphenyl)sulfanylthiophen-3-yl]-N,N-dimethylmethanamine;hydrochloride
Also Known As: N,N-Dimethyl-4-(3-methoxyphenylthio)-3-thienylamine hydrochloride, 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride, 4-((3-Methoxyphenyl)thio)-N,N-dimethyl-3-thiophenemethanamine hydrochloride, 1-[4-(3-methoxyphenyl)sulfanylthiophen-3-yl]-N,N-dimethylmethanamine hydrochloride, 1-{4-[(3-Methoxyphenyl)sulfanyl]thiophen-3-yl}-N,N-dimethylmethanamine--hydrogen chloride (1/1)
| Molecular Formula | C14H18ClNOS2 |
| Molecular Weight | 315.05185 g/mol |
| XLogP | 4.3913 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.05185 Da |
| Heavy Atoms | 19 |
| Complexity | 250.0 |
| SMILES | CN(C)CC1=CSC=C1SC2=CC=CC(=C2)OC.Cl |
| InChIKey | XIDJVHXEGHELIF-UHFFFAOYSA-N |
The XLogP value of 4.3913 indicates that 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride. Following Lipinski's Rule of Five, 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride 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 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride is 134478-63-0.
The molecular formula of 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride is C14H18ClNOS2.
The molecular weight of 3-Thiophenemethanamine, 4-((3-methoxyphenyl)thio)-N,N-dimethyl-, hydrochloride is 315.05185 g/mol.
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