Basic information
- CAS
1173927-30-4- Standard SMILES
CC(C)CCc1cnc2sccn2c1=O- InChIKey
NZVRBJOXLMGYOW-UHFFFAOYSA-N- Molecular formula
- C11H14N2OS
- Average molar mass
- 222.31 g/mol
- Monoisotopic mass
- 222.08268425
Names & identifiers
- Preferred name
- 6-Isopentyl-5H-thiazolo[3,2-a]pyrimidin-5-one
- IUPAC
- 6-(3-methylbutyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Names & synonyms
1173927-30-46-Isopentyl-5H-thiazolo[3,2-a]pyrimidin-5-oneDTXSID707050356-(3-Methylbutyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-oneDB-318136
Database identifiers
- CAS
1173927-30-4- PubChem CID
- 53486643
- DTXSID
DTXSID70705035
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 58 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 369
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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