4-(2-Chloro-4-quinazolinyl)-1-piperazineethanol
Basic information
- CAS
938517-67-0- Standard SMILES
OCCN1CCN(c2nc(Cl)nc3ccccc23)CC1- InChIKey
RJEQXNWDFWOHOB-UHFFFAOYSA-N- Molecular formula
- C14H17ClN4O
- Average molar mass
- 292.76 g/mol
- Monoisotopic mass
- 292.1090889
Names & identifiers
- Preferred name
- 4-(2-Chloro-4-quinazolinyl)-1-piperazineethanol
- IUPAC
- 2-[4-(2-chloroquinazolin-4-yl)piperazin-1-yl]ethanol
Names & synonyms
4-(2-Chloro-4-quinazolinyl)-1-piperazineethanolDTXSID001241988AKOS011764400938517-67-02-[4-(2-Chloroquinazolin-4-yl)piperazin-1-yl]ethan-1-ol
Database identifiers
- CAS
938517-67-0- PubChem CID
- 22693296
- DTXSID
DTXSID001241988
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 312
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Compound notes
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