Basic information
- Standard SMILES
Nc1nc(-c2ccc(CCN3CCN(c4cccc5cccnc45)CC3)cc2)cs1- InChIKey
CELJBRNZRYEIOH-UHFFFAOYSA-N- Molecular formula
- C24H25N5S
- Average molar mass
- 415.6 g/mol
- Monoisotopic mass
- 415.18306699
Names & identifiers
- Preferred name
- 4-(4-(2-(4-(8-Quinolyl)piperazinyl)ethyl)phenyl)-2-aminothiazole
- IUPAC
- 4-[4-[2-(4-quinolin-8-ylpiperazin-1-yl)ethyl]phenyl]-1,3-thiazol-2-amine
Names & synonyms
SCHEMBL9519273CELJBRNZRYEIOH-UHFFFAOYSA-N4-(4-(2-(4-(8-Quinolyl)piperazinyl)ethyl)phenyl)-2-aminothiazole
Database identifiers
- PubChem CID
- 14727006
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 86.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 532
Related reactions
1 records
Compound notes
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