TL;DR: 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride (CAS 1049715-44-7) is a chemical compound with molecular formula C17H17Cl2NO3 and molecular weight 353.05856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methyl]-1-(furan-2-yl)methanamine;hydrochloride
Also Known As: 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride, 1-[5-(3-chloro-4-methoxy-phenyl)-2-furyl]-N-(2-furylmethyl)methanamine Hydrochloride, N-[[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methyl]-1-(furan-2-yl)methanamine hydrochloride
| Molecular Formula | C17H17Cl2NO3 |
| Molecular Weight | 353.05856 g/mol |
| XLogP | 4.9132 |
| Topological Polar Surface Area (TPSA) | 47.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.05856 Da |
| Heavy Atoms | 23 |
| Complexity | 344.0 |
| SMILES | COC1=C(C=C(C=C1)C2=CC=C(O2)CNCC3=CC=CO3)Cl.Cl |
| InChIKey | CDIMBRASIMBXFH-UHFFFAOYSA-N |
The XLogP value of 4.9132 indicates that 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.5 Ų, 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride has 2 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 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride is 1049715-44-7.
The molecular formula of 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride is C17H17Cl2NO3.
The molecular weight of 1-(5-(3-chloro-4-methoxyphenyl)furan-2-yl)-N-(furan-2-ylmethyl)methanamine hydrochloride is 353.05856 g/mol.
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