Basic information
- Standard SMILES
NC(=O)c1ccc(Oc2ncc(CNCCc3cccs3)cc2Cl)cc1- InChIKey
ZJVBEWMKSYHYNI-UHFFFAOYSA-N- Molecular formula
- C19H18ClN3O2S
- Average molar mass
- 387.9 g/mol
- Monoisotopic mass
- 387.0808257
Names & identifiers
- Preferred name
- 4-{3-Chloro-5-[(2-thiophen-2-yl-ethylamino)-methyl]-pyridin-2-yloxy}-benzamide
- IUPAC
- 4-[[3-chloro-5-[(2-thiophen-2-ylethylamino)methyl]-2-pyridinyl]oxy]benzamide
Names & synonyms
SCHEMBL3692012ZJVBEWMKSYHYNI-UHFFFAOYSA-N4-{3-Chloro-5-[(2-thiophen-2-yl-ethylamino)-methyl]-pyridin-2-yloxy}-benzamide
Database identifiers
- PubChem CID
- 59730129
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 449
Related reactions
4 records
Compound notes
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