Basic information
- CAS
22177-96-4- Standard SMILES
CCCc1nc(Cl)cc(N(CCO)CCO)n1- InChIKey
LHCBIPTVVPSANL-UHFFFAOYSA-N- Molecular formula
- C11H18ClN3O2
- Average molar mass
- 259.73 g/mol
- Monoisotopic mass
- 259.1087545
Names & identifiers
- Preferred name
- 2,2'-[(6-Chloro-2-propylpyrimidin-4-yl)azanediyl]di(ethan-1-ol)
- IUPAC
- 2-[(6-chloro-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
Names & synonyms
DTXSID001198173AKOS0195080472,2'-[(6-Chloro-2-propylpyrimidin-4-yl)azanediyl]di(ethan-1-ol)Ethanol, 2,2a(2)-[(6-chloro-2-propyl-4-pyrimidinyl)imino]di-22177-96-4
Database identifiers
- CAS
22177-96-4- PubChem CID
- 80939207
- DTXSID
DTXSID001198173
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 69.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…