RefChem:385134
[4-hydroxy-3-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl] thiocyanate
Also Known As: 5-chloro-pentylsulfanyl cyanate|Thiocyanic acid, 4-hydroxy-3-methyl-5-((4-methyl-1-piperazinyl)methyl)phenyl ester|Thiocyanic acid, 4-hydroxy-alpha-3-(4-methyl-1-piperazinyl)-3,5-xylyl ester|[4-hydroxy-3-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl] thiocyanate|4-hydroxy-3-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenylthiocyanate|4-Hydroxy-3-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl thiocyanate|Thiocyanic acid, 4-hydroxy-3-methyl-5-[(4-methyl-1-piperazinyl)methyl]phenyl ester|Thiocyanic acid,4-hydroxy-3-methyl-5-[(4-methyl-1-piperazinyl)methyl]phenyl ester
| Molecular Formula | C14H19N3OS |
|---|---|
| Molecular Weight | 277.12488 g/mol |
| LogP | 2.02 |
| Topological Polar Surface Area | 50.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.12488 |
| Heavy Atoms | 19 |
| Complexity | 490.2 |
Chemical Identifiers
| CAS Number | 64048-03-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)CN2CCN(CC2)C)SC#N |
Product Overview
RefChem:385134 (CAS 64048-03-9), with molecular formula C14H19N3OS and molecular weight 277.12488 g/mol. IUPAC: [4-hydroxy-3-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl] thiocyanate.
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