Basic information
- Standard SMILES
COc1cccc([C@@H](Oc2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@H](C)NC(=O)c2sc(C(F)(F)F)cc2O)c1- InChIKey
MWNWUPRAJAGUJH-QMTYFTJSSA-N- Molecular formula
- C29H23F4N3O4S
- Average molar mass
- 585.6 g/mol
Names & identifiers
- Preferred name
- N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-hydroxy-5-(trifluoromethyl)thiophene-2-carboxamide
- IUPAC
- N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-hydroxy-5-(trifluoromethyl)thiophene-2-carboxamide
Names & synonyms
N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-hydroxy-5-(trifluoromethyl)thiophene-2-carboxamideSCHEMBL835446N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2yl]-3-hydroxy-5-(trifluoromethyl)thiophene-2-carboxamide
Database identifiers
- PubChem CID
- 59339799
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 879
Related reactions
2 records
Compound notes
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