CK 683A
1-(1-adamantyl)-3-[N'-[3-[3-[[(1-adamantylcarbamoylamino)-aminomethylidene]amino]propyl-methylamino]propyl]carbamimidoyl]urea;methanesulfonic acid
| Molecular Formula | C32H57N9O5S |
|---|---|
| Molecular Weight | 679.9 g/mol |
| Topological Polar Surface Area | 225.0 A2 |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 679.42035 |
| Heavy Atoms | 47 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 83539-21-3 |
|---|---|
| SMILES | CN(CCCN=C(N)NC(=O)NC12CC3CC(C1)CC(C3)C2)CCCN=C(N)NC(=O)NC45CC6CC(C4)CC(C6)C5.CS(=O)(=O)O |
| InChIKey | LJDCZTFYPZNDAD-UHFFFAOYSA-N |
📖 Product Overview
CK 683A (CAS: 83539-21-3) is a chemical compound with molecular formula C32H57N9O5S and molecular weight 679.9 g/mol. Its IUPAC systematic name is 1-(1-adamantyl)-3-[N'-[3-[3-[[(1-adamantylcarbamoylamino)-aminomethylidene]amino]propyl-methylamino]propyl]carbamimidoyl]urea;methanesulfonic acid.
LJDCZTFYPZNDAD-UHFFFAOYSA-N.
SMILES: CN(CCCN=C(N)NC(=O)NC12CC3CC(C1)CC(C3)C2)CCCN=C(N)NC(=O)NC45CC6CC(C4)CC(C6)C5.CS(=O)(=O)O.
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