TL;DR: 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl- (CAS 138878-44-1) is a chemical compound with molecular formula C20H32N2O2S2 and molecular weight 396.19052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[5-[4-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]butylsulfanylmethyl]furan-2-yl]-N,N-dimethylmethanamine
Also Known As: 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl-, 5,5'-(1,4-Butanediylbis(thiomethylene))bis(N,N-dimethyl-2-furanmethanamine), 2,2 -[1,4-Butanediylbis(thiomethylene)]bis[5-(dimethylaminomethyl)furan], ({5-[({4-[({5-[(dimethylamino)methyl]furan-2-yl}methyl)sulfanyl]butyl}sulfanyl)methyl]furan-2-yl}methyl)dimethylamine, {5-[4-(5-Dimethylaminomethyl-furan-2-ylmethylsulfanyl)-butylsulfanylmethyl]-furan-2-ylmethyl}-dimethyl-amine
| Molecular Formula | C20H32N2O2S2 |
| Molecular Weight | 396.19052 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 83.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 396.19052 Da |
| Heavy Atoms | 26 |
| Complexity | 338.0 |
| SMILES | CN(C)CC1=CC=C(O1)CSCCCCSCC2=CC=C(O2)CN(C)C |
| InChIKey | QLQLZILPUSPCNJ-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl-. Following Lipinski's Rule of Five, 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl- has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl- is 138878-44-1.
The molecular formula of 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl- is C20H32N2O2S2.
The molecular weight of 2-Furanmethanamine, 5,5'-(1,4-butanediylbis(thiomethylene))bis(N,N-dimethyl- is 396.19052 g/mol.
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