Basic information
- Standard SMILES
O=C(NC(CC1CC1)c1nccs1)c1cccc(-c2cccc(Cl)c2)n1- InChIKey
MLVAGLLUHSSLOL-UHFFFAOYSA-N- Molecular formula
- C20H18ClN3OS
- Average molar mass
- 383.9 g/mol
Names & identifiers
- Preferred name
- 6-(3-chlorophenyl)-N-[2-cyclopropyl-1-(1,3-thiazol-2-yl)ethyl]pyridine-2-carboxamide
- IUPAC
- 6-(3-chlorophenyl)-N-[2-cyclopropyl-1-(1,3-thiazol-2-yl)ethyl]pyridine-2-carboxamide
Names & synonyms
SCHEMBL20057420
Database identifiers
- PubChem CID
- 78010099
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 490
Related reactions
1 records
Compound notes
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