Basic information
- CAS
1257078-15-1- Standard SMILES
CN(C)/C=C/C(=O)c1c(Cl)nc2ccccn12- InChIKey
JSARJYDQVBBECZ-SOFGYWHQSA-N- Molecular formula
- C12H12ClN3O
- Average molar mass
- 249.69 g/mol
- Monoisotopic mass
- 249.0668897
Names & identifiers
- Preferred name
- (E)-1-(2-chloroimidazo[1,2-a]pyridin-3-yl)-3-(dimethylamino)prop-2-en-1-one
- IUPAC
- (E)-1-(2-chloroimidazo[1,2-a]pyridin-3-yl)-3-(dimethylamino)prop-2-en-1-one
Names & synonyms
SCHEMBL3755232JSARJYDQVBBECZ-SOFGYWHQSA-NDTXSID201140770(E)-1-(2-chloroimidazo[1,2-a]pyridin-3-yl)-3-(dimethylamino)prop-2-en-1-one1257078-15-1(2E)-1-(2-Chloroimidazo[1,2-a]pyridin-3-yl)-3-(dimethylamino)-2-propen-1-one(2E)-1-(2-Chloroimidazo[1,2-a]pyridin-3-yl)-3-(dimethylamino)prop-2-en-1-one
Database identifiers
- CAS
1257078-15-1- PubChem CID
- 59606857
- DTXSID
DTXSID201140770
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 37.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 319
Related reactions
1 records
Compound notes
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