1-Piperazineethanol, 4-(2-ethoxyphenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-, monohydrochloride
Basic information
- CAS
136996-75-3- Standard SMILES
CCOc1ccccc1N1CCN(CC(O)COc2scnc2C)CC1.Cl- InChIKey
WHFTXXOJHGXIDG-UHFFFAOYSA-N- Molecular formula
- C19H28ClN3O3S
- Average molar mass
- 414 g/mol
- Monoisotopic mass
- 413.1539906
Names & identifiers
- Preferred name
- 1-Piperazineethanol, 4-(2-ethoxyphenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-, monohydrochloride
- IUPAC
- 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-[(4-methyl-1,3-thiazol-5-yl)oxy]propan-2-ol;hydrochloride
Names & synonyms
B 13921-Piperazineethanol, 4-(2-ethoxyphenyl)-alpha-(((4-methyl-5-thiazolyl)oxy)methyl)-, monohydrochloride136996-75-33-(4-o-Ethoxyphenylpiperazin-1-yl)-1-(4-methyl-thiazolyl-5-oxy)propan-2-ol hydrochlorideRefChem:233734DTXSID209296431-[4-(2-Ethoxyphenyl)piperazin-1-yl]-3-[(4-methyl-1,3-thiazol-5-yl)oxy]propan-2-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
136996-75-3- PubChem CID
- 3078080
- DTXSID
DTXSID20929643
Properties
Computed structural properties
- Topological polar surface area
- 86.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 409
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…