Ethanol, 2,2'-((2-((4,6-di-2-thienyl-2-pyrimidinyl)oxy)ethyl)imino)bis-
Basic information
- CAS
124959-48-4- Standard SMILES
OCCN(CCO)CCOc1nc(-c2cccs2)cc(-c2cccs2)n1- InChIKey
KNOSZXOTJYHVKE-UHFFFAOYSA-N- Molecular formula
- C18H21N3O3S2
- Average molar mass
- 391.5 g/mol
- Monoisotopic mass
- 391.10243389
Names & identifiers
- Preferred name
- Ethanol, 2,2'-((2-((4,6-di-2-thienyl-2-pyrimidinyl)oxy)ethyl)imino)bis-
- IUPAC
- 2-[2-(4,6-dithiophen-2-ylpyrimidin-2-yl)oxyethyl-(2-hydroxyethyl)amino]ethanol
Names & synonyms
124959-48-4Ethanol, 2,2'-((2-((4,6-di-2-thienyl-2-pyrimidinyl)oxy)ethyl)imino)bis-2-(2-(Di(hydroxyethyl)amino)ethoxy)-4,6-dithienylpyrimidineTriethanolamine, mono(4,6-bis(2-thienyl)pyrimidin-2-yl)ether2,2'-((2-((4,6-Di(thiophen-2-yl)pyrimidin-2-yl)oxy)ethyl)azanediyl)diethanolTriethanolamine, mono[4,6-bis(2-thienyl)pyrimidin-2-yl]etherEthanol, 2,2'-[[2-[(4,6-di-2-thienyl-2-pyrimidinyl)oxy]ethyl]imino]bis-DTXSID301545252,2'-[(2-{[4,6-Di(thiophen-2-yl)pyrimidin-2-yl]oxy}ethyl)azanediyl]di(ethan-1-ol)2-[2-[4,6-bis(2-thienyl)pyrimidin-2-yl]oxyethyl-(2-hydroxyethyl)amino]ethanol
Database identifiers
- CAS
124959-48-4- PubChem CID
- 451507
- DTXSID
DTXSID30154525
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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