Basic information
- Standard SMILES
CN(Cc1cc2cnccc2s1)C(=O)/C=C/c1ccc(N)nc1- InChIKey
NECNMNQCVVFYGZ-HWKANZROSA-N- Molecular formula
- C17H16N4OS
- Average molar mass
- 324.4 g/mol
- Monoisotopic mass
- 324.10448232
Names & identifiers
- Preferred name
- (E)-3-(6-Amino-pyridin-3-yl)-N-methyl-N-thieno[3,2-c]pyridin-2-ylmethyl-acrylamide
- IUPAC
- (E)-3-(6-amino-3-pyridinyl)-N-methyl-N-(thieno[3,2-c]pyridin-2-ylmethyl)prop-2-enamide
Names & synonyms
SCHEMBL1253290NECNMNQCVVFYGZ-HWKANZROSA-N(E)-3-(6-Amino-pyridin-3-yl)-N-methyl-N-thieno[3,2-c]pyridin-2-ylmethyl-acrylamide
Database identifiers
- PubChem CID
- 66967013
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 444
Related reactions
2 records
Compound notes
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