Basic information
- Standard SMILES
CCN(C/C=C/Cl)Cc1cccc(OCc2cccc(-c3ccsc3)c2)c1- InChIKey
PVFCQNAWTMCQFL-VZUCSPMQSA-N- Molecular formula
- C23H24ClNOS
- Average molar mass
- 398 g/mol
- Monoisotopic mass
- 397.1267133
Names & identifiers
- Preferred name
- (E)-N-(3-chloro-2-propenyl)-N-ethyl-3-[3-(3-thienyl)benzyloxy]benzylamine
- IUPAC
- (E)-3-chloro-N-ethyl-N-[[3-[(3-thiophen-3-ylphenyl)methoxy]phenyl]methyl]prop-2-en-1-amine
Names & synonyms
SCHEMBL9052543PVFCQNAWTMCQFL-VZUCSPMQSA-N(E)-N-(3-chloro-2-propenyl)-N-ethyl-3-[3-(3thienyl)benzyloxy]benzylamine(E)-N-(3-chloro-2-propenyl )-N-ethyi-3-[3-(3-thienyl)benzyloxy]benzylamine(E)-N-(3-chloro-2-propenyl)-N-ethyl-3-[3-(3-thienyl)benzyloxy]benzylamine
Database identifiers
- PubChem CID
- 19917481
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 40.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 446
Related reactions
11 records
Compound notes
Loading…