Basic information
- Standard SMILES
CC(=O)N1CCc2c(sc(C)c2CCCl)C1- InChIKey
MXOAXGPFXGTQON-UHFFFAOYSA-N- Molecular formula
- C12H16ClNOS
- Average molar mass
- 257.78 g/mol
Names & identifiers
- Preferred name
- 6-Acetyl-3-(2-chloroethyl)-4,5,6,7-tetrahydro-2-methylthieno[2,3-c]pyridine
- IUPAC
- 1-[3-(2-chloroethyl)-2-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl]ethanone
Names & synonyms
SCHEMBL8915764MXOAXGPFXGTQON-UHFFFAOYSA-N6-acetyl-3-(2-chloroethyl)-4,5,6,7-tetrahydro-2-methylthieno[2,3-c]pyridine
Database identifiers
- PubChem CID
- 21471856
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 48.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 274
Related reactions
13 records
Compound notes
Loading…