Basic information
- Standard SMILES
OC1CC(c2nc3ccc(-c4cncnc4)cc3s2)C1- InChIKey
WTPZYTWPMSWCKG-UHFFFAOYSA-N- Molecular formula
- C15H13N3OS
- Average molar mass
- 283.4 g/mol
Names & identifiers
- Preferred name
- Cis-3-(6-pyrimidin-5-yl-1,3-benzothiazol-2-yl)cyclobutanol
- IUPAC
- 3-(6-pyrimidin-5-yl-1,3-benzothiazol-2-yl)cyclobutan-1-ol
Names & synonyms
SCHEMBL1743444SCHEMBL1743445WTPZYTWPMSWCKG-KLPPZKSPSA-NCis-3-(6-pyrimidin-5-yl-1,3-benzothiazol-2-yl)cyclobutanol
Database identifiers
- PubChem CID
- 67145192
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 344
Related reactions
1 records
Compound notes
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