TL;DR: Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride (CAS 25068-97-7) is a chemical compound with molecular formula C12H20ClNO2 and molecular weight 245.11826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,4-dimethoxy-3-methylphenyl)propan-2-amine;hydrochloride
Also Known As: KST-1B2321, 2,4-Dimethoxy-3-methylamphetamine hydrochloride, 1-(2,4-Dimethoxy-3-methylphenyl)-2-aminopropane, Amphetamine, 2,4-dimethoxy-3-methyl-, hydrochloride, Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride
| Molecular Formula | C12H20ClNO2 |
| Molecular Weight | 245.11826 g/mol |
| XLogP | 2.32 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.11826 Da |
| Heavy Atoms | 16 |
| Complexity | 186.0 |
| SMILES | CC1=C(C=CC(=C1OC)CC(C)N)OC.Cl |
| InChIKey | SZORJUSWVVQOIR-UHFFFAOYSA-N |
The XLogP value of 2.32 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride. With a topological polar surface area (TPSA) of 44.5 Ų, Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride has 2 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 Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride is 25068-97-7.
The molecular formula of Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride is C12H20ClNO2.
The molecular weight of Phenethylamine, 2,4-dimethoxy-alpha,3-dimethyl-, hydrochloride is 245.11826 g/mol.
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