2-[3-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;hydrochloride
Basic information
- Standard SMILES
Cc1ncc(C[n+]2csc(CCO)c2C)c(N)n1.Cl- InChIKey
MYVIATVLJGTBFV-UHFFFAOYSA-N- Molecular formula
- C12H18ClN4OS+
- Average molar mass
- 301.82 g/mol
Names & identifiers
- Preferred name
- 2-[3-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;hydrochloride
- IUPAC
- 2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;hydrochloride
Names & synonyms
2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethanol;hydrochlorideSCHEMBL193755MYVIATVLJGTBFV-UHFFFAOYSA-NAKOS015960719AC-12129
Database identifiers
- PubChem CID
- 574516
Properties
Computed structural properties
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 1
- Complexity
- 268
Related reactions
1 records
Compound notes
Loading…