2-Methyl-N-[3-(2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanimidic acid--hydrogen chloride (1/1)
Basic information
- CAS
54400-62-3- Standard SMILES
CC(C)C(=O)Nc1cccc(C2CN3CCSC3=N2)c1.Cl- InChIKey
FXYKKPLSQTYWRY-UHFFFAOYSA-N- Molecular formula
- C15H20ClN3OS
- Average molar mass
- 325.9 g/mol
- Monoisotopic mass
- 325.1015611
Names & identifiers
- Preferred name
- 2-Methyl-N-[3-(2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanimidic acid--hydrogen chloride (1/1)
- IUPAC
- 2-methyl-N-[3-(2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide;hydrochloride
Names & synonyms
CHEMBL2106130SCHEMBL11576049DTXSID30969535D031852-Methyl-N-[3-(2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanimidic acid--hydrogen chloride (1/1)
Database identifiers
- CAS
54400-62-3- PubChem CID
- 166571
- DTXSID
DTXSID30969535- ChEMBL
CHEMBL2106130
Properties
Computed structural properties
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 410
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Compound notes
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