Basic information
- Standard SMILES
Cc1oc(C(=O)O)cc1CNc1ccc(-c2ccc(OC(F)F)cc2)cc1- InChIKey
RMTSDFUOCODELU-UHFFFAOYSA-N- Molecular formula
- C20H17F2NO4
- Average molar mass
- 373.3 g/mol
Names & identifiers
- Preferred name
- 4-(4'-Difluoromethoxy-biphenyl-4-ylaminomethyl)-5-methyl-furan-2-carboxylic acid
- IUPAC
- 4-[[4-[4-(difluoromethoxy)phenyl]anilino]methyl]-5-methylfuran-2-carboxylic acid
Names & synonyms
4-(4'-Difluoromethoxy-biphenyl-4-ylaminomethyl)-5-methyl-furan-2-carboxylic acidSCHEMBL3534763
Database identifiers
- PubChem CID
- 18444564
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 71.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 477
Related reactions
14 records
Compound notes
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