Basic information
- Standard SMILES
C=CCNc1nc(C=O)cs1- InChIKey
UPWRBWUKVKBFIM-UHFFFAOYSA-N- Molecular formula
- C7H8N2OS
- Average molar mass
- 168.22 g/mol
- Monoisotopic mass
- 168.03573406
Names & identifiers
- Preferred name
- 2-Allylaminothiazole-4-carbaldehyde
- IUPAC
- 2-(prop-2-enylamino)-1,3-thiazole-4-carbaldehyde
Names & synonyms
SCHEMBL10464269UPWRBWUKVKBFIM-UHFFFAOYSA-N2-allylaminothiazole-4-carbaldehyde
Database identifiers
- PubChem CID
- 15053576
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 70.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 151
Related reactions
4 records
Compound notes
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