TL;DR: LU 4-064 hydrochloride (CAS 26106-00-3) is a chemical compound with molecular formula C19H24ClNS and molecular weight 333.1318 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[3-(1-phenyl-3H-2-benzothiophen-1-yl)propyl]azanium chloride
Also Known As: LU 4-064 hydrochloride, 1,3-Dihydro-N,N-dimethyl-1-phenylbenzo(c)thiophene-1-propylamine hydrochloride, dimethyl-[3-(1-phenyl-3H-2-benzothiophen-1-yl)propyl]azanium chloride, Benzo(c)thiophene-1-propylamine, 1,3-dihydro-N,N-dimethyl-1-phenyl-, hydrochloride
| Molecular Formula | C19H24ClNS |
| Molecular Weight | 333.1318 g/mol |
| XLogP | 0.11 |
| Topological Polar Surface Area (TPSA) | 29.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.1318 Da |
| Heavy Atoms | 22 |
| Complexity | 324.0 |
| SMILES | C[NH+](C)CCCC1(C2=CC=CC=C2CS1)C3=CC=CC=C3.[Cl-] |
| InChIKey | VSWNHWPQNUCKEF-UHFFFAOYSA-N |
The XLogP value of 0.11 suggests moderate lipophilicity, balancing water solubility and membrane permeability for LU 4-064 hydrochloride. With a topological polar surface area (TPSA) of 29.7 Ų, LU 4-064 hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, LU 4-064 hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of LU 4-064 hydrochloride is 26106-00-3.
The molecular formula of LU 4-064 hydrochloride is C19H24ClNS.
The molecular weight of LU 4-064 hydrochloride is 333.1318 g/mol.
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