Basic information
- Standard SMILES
CCC(=O)NC1COc2cc(NS(=O)(=O)c3ccc(OC(F)(F)F)cc3)cnc2C1- InChIKey
ZYVXPSAIAGNMDH-UHFFFAOYSA-N- Molecular formula
- C18H18F3N3O5S
- Average molar mass
- 445.4 g/mol
Names & identifiers
- Preferred name
- N-[7-(4-Trifluoromethoxy-benzenesulfonylamino)-3,4-dihydro-2H-pyrano[3,2-b]pyridin-3-yl]-propionamide
- IUPAC
- N-[7-[[4-(trifluoromethoxy)phenyl]sulfonylamino]-3,4-dihydro-2H-pyrano[3,2-b]pyridin-3-yl]propanamide
Names & synonyms
N-[7-(4-Trifluoromethoxy-benzenesulfonylamino)-3,4-dihydro-2H-pyrano[3,2-b]pyridin-3-yl]-propionamideSCHEMBL4107122
Database identifiers
- PubChem CID
- 68914768
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 692
Related reactions
2 records
Compound notes
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