1,1'-Hexamethylenebis(3-(3-pyridylmethyl)urea)
1-(pyridin-3-ylmethyl)-3-[6-(pyridin-3-ylmethylcarbamoylamino)hexyl]urea
Also Known As: Kinome_2048|1,1'-hexamethylenebis(3-(3-pyridylmethyl)urea)|1,1'-hexane-1,6-diylbis[3-(pyridin-3-ylmethyl)urea]|1-(pyridin-3-ylmethyl)-3-[6-(pyridin-3-ylmethylcarbamoylamino)hexyl]urea|3-(pyridin-3-ylmethyl)-1-[6-(pyridin-3-ylmethylcarbamoylamino)hexyl]urea|[(3-pyridylmethyl)amino]-N-(6-{[(3-pyridylmethyl)amino]carbonylamino}hexyl)car boxamide|667-218-1
CAS: 39642-86-9
| Molecular Formula | C20H28N6O2 |
|---|---|
| Molecular Weight | 384.2274 g/mol |
| LogP | 2.3356 |
| Topological Polar Surface Area | 108.04 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 384.2274 |
| Monoisotopic Mass | 384.2274 |
| Heavy Atoms | 28 |
| Complexity | 634.8568 |
Chemical Identifiers
| CAS Number | 39642-86-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)CNC(=O)NCCCCCCNC(=O)NCC2=CN=CC=C2 |
Product Overview
1,1'-Hexamethylenebis(3-(3-pyridylmethyl)urea) (CAS 39642-86-9), with molecular formula C20H28N6O2 and molecular weight 384.2274 g/mol. IUPAC: 1-(pyridin-3-ylmethyl)-3-[6-(pyridin-3-ylmethylcarbamoylamino)hexyl]urea.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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