C24H30F6N10.2ClH
[N'-[N'-[3-(trifluoromethyl)phenyl]carbamimidoyl]carbamimidoyl]-[6-[[N'-[N'-[3-(trifluoromethyl)phenyl]carbamimidoyl]carbamimidoyl]azaniumyl]hexyl]azanium dichloride
Also Known As: CTK1D7142|Biguanide, 1,1'-hexamethylenebis(5-(alpha,alpha,alpha-trifluoro-m-tolyl)-, dihydrochloride|[N-[N-[3-(trifluoromethyl)phenyl]carbamimidoyl]carbamimidoyl]-[6-[N-[N-[3-(trifluoromethyl)phenyl]carbamimidoyl]carbamimidoyl]ammoniohexyl]azanium dichloride|1,6-Di(N(sub 1),N(sub 1')-m-trifluoromethylphenyl)-N(sub 5),N(sub 5')-hexane dihydrochloride
| Molecular Formula | C24H32Cl2F6N10 |
|---|---|
| Molecular Weight | 644.2093 g/mol |
| LogP | -4.36 |
| Topological Polar Surface Area | 186.74 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 644.2093 |
| Heavy Atoms | 42 |
| Complexity | 1151.2 |
Chemical Identifiers
| CAS Number | 42242-51-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N=C(N)N=C(N)[NH2+]CCCCCC[NH2+]C(=NC(=NC2=CC=CC(=C2)C(F)(F)F)N)N)C(F)(F)F.[Cl-].[Cl-] |
Product Overview
C24H30F6N10.2ClH (CAS 42242-51-3), with molecular formula C24H32Cl2F6N10 and molecular weight 644.2093 g/mol. IUPAC: [N'-[N'-[3-(trifluoromethyl)phenyl]carbamimidoyl]carbamimidoyl]-[6-[[N'-[N'-[3-(trifluoromethyl)phenyl]carbamimidoyl]carbamimidoyl]azaniumyl]hexyl]azanium dichloride.
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