TL;DR: 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)- (CAS 1161-44-0) is a chemical compound with molecular formula C20H40Cl2N2 and molecular weight 378.25687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[4-[(cyclohexylamino)methyl]cyclohexyl]methyl]cyclohexanamine;dihydrochloride
Also Known As: 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)-, trans-N,N'-Dicyclohexyl-1,4-cyclohexanebis(methylamine) dihydrochloride, Cyclohexylamine, N,N'-(1,4-cyclohexylenedimethylene)di-, dihydrochloride, (E)-, trans-N,N'-(1,4-Cyclohexylenedimethylene)dicyclohexylamine dihydrochloride, n,n'-(cyclohexane-1,4-diyldimethanediyl)dicyclohexanamine dihydrochloride
| Molecular Formula | C20H40Cl2N2 |
| Molecular Weight | 378.25687 g/mol |
| XLogP | 5.48 |
| Topological Polar Surface Area (TPSA) | 24.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.25687 Da |
| Heavy Atoms | 24 |
| Complexity | 254.0 |
| SMILES | C1CCC(CC1)NCC2CCC(CC2)CNC3CCCCC3.Cl.Cl |
| InChIKey | YXUJYFMPMLQKNJ-UHFFFAOYSA-N |
The XLogP value of 5.48 indicates that 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)- has 4 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)- is 1161-44-0.
The molecular formula of 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)- is C20H40Cl2N2.
The molecular weight of 1,4-Cyclohexanebis(methylamine), N,N'-dicyclohexyl-, dihydrochloride, (E)- is 378.25687 g/mol.
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