TL;DR: N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride (CAS 1049681-25-5) is a chemical compound with molecular formula C15H22Cl2N2O and molecular weight 316.11093 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N',N'-dimethyl-N-[(5-phenylfuran-2-yl)methyl]ethane-1,2-diamine;dihydrochloride
Also Known As: N',N'-dimethyl-N-[(5-phenyl-2-furyl)methyl]ethane-1,2-diamine Dihydrochloride, N',N'-dimethyl-N-[(5-phenylfuran-2-yl)methyl]ethane-1,2-diamine dihydrochloride, N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride
| Molecular Formula | C15H22Cl2N2O |
| Molecular Weight | 316.11093 g/mol |
| XLogP | 3.4414 |
| Topological Polar Surface Area (TPSA) | 28.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 316.11093 Da |
| Heavy Atoms | 20 |
| Complexity | 227.0 |
| SMILES | CN(C)CCNCC1=CC=C(O1)C2=CC=CC=C2.Cl.Cl |
| InChIKey | MCAKCVWGROEOOW-UHFFFAOYSA-N |
The XLogP value of 3.4414 indicates that N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.4 Ų, N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride has 3 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 N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride is 1049681-25-5.
The molecular formula of N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride is C15H22Cl2N2O.
The molecular weight of N1,N1-dimethyl-N2-((5-phenylfuran-2-yl)methyl)ethane-1,2-diamine dihydrochloride is 316.11093 g/mol.
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